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#$Date: 2024-11-16 00:24:31 +0200 (Sat, 16 Nov 2024) $
#$Revision: 295947 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/11/86/4118647.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4118647
loop_
_publ_author_name
'Makoto Hachiya'
'Hidefumi Nikawa'
'Naomi Mizorogi'
'Takahiro Tsuchiya'
'Xing Lu'
'Takeshi Akasaka'
_publ_contact_author_address
;Aspect of Creation of New Materials
Center for Tsukuba Advanced Research Alliance
University of Tsukuba
Tsukuba, Ibaraki 305-8577, Japan 
;
_publ_contact_author_email       akasaka@tara.tsukuba.ac.jp
_publ_contact_author_fax         +81-298-53-6409
_publ_contact_author_name        'Takeshi AKASAKA'
_publ_contact_author_phone       +81-298-53-6409
_publ_section_title
;
 Exceptional Chemical Properties of Sc@C2v(9)-C82 Probed with
 Adamantylidene Carbene
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              15550
_journal_page_last               15555
_journal_paper_doi               10.1021/ja306890x
_journal_volume                  134
_journal_year                    2012
_chemical_formula_moiety         'Sc C92 H14, 2.5(C1 S2)'
_chemical_formula_sum            'C94.5 H14 S5 Sc'
_chemical_formula_weight         1354.32
_chemical_name_common            Sc@C82Ad-A
_chemical_name_systematic        Sc@C82Ad-A
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 101.644(9)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.332(3)
_cell_length_b                   21.875(5)
_cell_length_c                   20.992(4)
_cell_measurement_temperature    110(2)
_cell_volume                     5097(2)
_computing_cell_refinement       PROCESS-AUTO
_computing_data_collection       PROCESS-AUTO
_computing_data_reduction        Yadokari-XG
_computing_molecular_graphics    Yadokari-XG
_computing_publication_material  Yadokari-XG
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      110(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID'
_diffrn_measurement_method       ω
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.0658
_diffrn_reflns_av_sigmaI/netI    0.0544
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       29
_diffrn_reflns_limit_k_min       -29
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_number            51727
_diffrn_reflns_theta_full        28.50
_diffrn_reflns_theta_max         28.50
_diffrn_reflns_theta_min         3.05
_exptl_absorpt_coefficient_mu    0.417
_exptl_absorpt_correction_T_max  0.9595
_exptl_absorpt_correction_T_min  0.8851
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            Black
_exptl_crystal_density_diffrn    1.765
_exptl_crystal_description       Block
_exptl_crystal_F_000             2728
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.912
_refine_diff_density_min         -0.735
_refine_diff_density_rms         0.101
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.057
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1264
_refine_ls_number_reflns         12903
_refine_ls_number_restraints     1542
_refine_ls_restrained_S_all      1.055
_refine_ls_R_factor_all          0.1076
_refine_ls_R_factor_gt           0.0827
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1029P)²+10.3496P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2109
_refine_ls_wR_factor_ref         0.2234
_reflns_number_gt                9013
_reflns_number_total             12903
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ja306890x_si_002.cif
_cod_data_source_block           sc@c82ad_110k
_cod_original_cell_volume        5096.6(19)
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_original_formula_sum        'C94.50 H14 S5 Sc'
_cod_database_code               4118647
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C -0.0763(5) 0.19756(16) 0.3888(3) 0.0166(12) Uani 0.850(2) 1 d PD A 2
C2 C -0.1098(3) 0.19132(16) 0.45646(16) 0.0187(6) Uani 0.850(2) 1 d P A 2
H2 H -0.0778 0.1517 0.4766 0.022 Uiso 0.850(2) 1 calc PR A 2
C3 C -0.1268(4) 0.25837(18) 0.3578(2) 0.0331(10) Uani 0.850(2) 1 d P A 2
H3 H -0.1052 0.2631 0.3142 0.040 Uiso 0.850(2) 1 calc PR A 2
C4 C -0.2640(5) 0.2575(2) 0.3502(2) 0.0370(10) Uani 0.850(2) 1 d P A 2
H4A H -0.2985 0.2956 0.3286 0.044 Uiso 0.850(2) 1 calc PR A 2
H4B H -0.2979 0.2225 0.3226 0.044 Uiso 0.850(2) 1 calc PR A 2
C5 C -0.0740(5) 0.31132(19) 0.4017(3) 0.0394(11) Uani 0.850(2) 1 d P A 2
H5A H -0.1059 0.3505 0.3817 0.047 Uiso 0.850(2) 1 calc PR A 2
H5B H 0.0147 0.3118 0.4066 0.047 Uiso 0.850(2) 1 calc PR A 2
C6 C -0.2471(4) 0.19179(18) 0.4476(2) 0.0244(8) Uani 0.850(2) 1 d P A 2
H6A H -0.2816 0.1573 0.4194 0.029 Uiso 0.850(2) 1 calc PR A 2
H6B H -0.2700 0.1866 0.4904 0.029 Uiso 0.850(2) 1 calc PR A 2
C7 C -0.0562(5) 0.2443(3) 0.5013(3) 0.0282(12) Uani 0.850(2) 1 d P A 2
H7A H -0.0780 0.2398 0.5445 0.034 Uiso 0.850(2) 1 calc PR A 2
H7B H 0.0328 0.2442 0.5075 0.034 Uiso 0.850(2) 1 calc PR A 2
C8 C -0.2976(3) 0.25204(19) 0.41699(19) 0.0283(8) Uani 0.850(2) 1 d P A 2
H8 H -0.3873 0.2520 0.4117 0.034 Uiso 0.850(2) 1 calc PR A 2
C9 C -0.1074(4) 0.30449(18) 0.4693(2) 0.0320(9) Uani 0.850(2) 1 d P A 2
H9 H -0.0726 0.3396 0.4975 0.038 Uiso 0.850(2) 1 calc PR A 2
C10 C -0.2446(4) 0.3052(2) 0.4611(2) 0.0258(10) Uani 0.850(2) 1 d P A 2
H10A H -0.2771 0.3444 0.4416 0.031 Uiso 0.850(2) 1 calc PR A 2
H10B H -0.2671 0.3010 0.5041 0.031 Uiso 0.850(2) 1 calc PR A 2
C1A C -0.1111(3) 0.14307(13) 0.34625(13) 0.0220(3) Uani 0.850(2) 1 d PD A 2
C2A C 0.0541(3) 0.18653(14) 0.38739(13) 0.0220(3) Uani 0.850(2) 1 d PD A 2
C3A C -0.1033(10) 0.0782(4) 0.3740(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C4A C -0.0086(7) 0.0506(4) 0.4238(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C5A C 0.1010(6) 0.0857(3) 0.4461(5) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C6A C 0.1310(7) 0.1468(3) 0.4263(5) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C7A C 0.0968(7) 0.2062(5) 0.3245(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C8A C 0.0333(6) 0.1993(5) 0.2558(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C9A C -0.0772(7) 0.1652(4) 0.2310(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C10A C -0.1361(9) 0.1355(4) 0.2780(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C11A C -0.1801(11) 0.0741(4) 0.2616(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C12A C -0.1582(11) 0.0405(5) 0.3205(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C13A C -0.1457(10) -0.0249(4) 0.3183(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C14A C -0.0659(6) -0.0530(4) 0.3696(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C15A C 0.0043(7) -0.0154(3) 0.4195(5) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C16A C 0.1199(5) -0.0441(3) 0.4413(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C17A C 0.2259(6) -0.0114(3) 0.4630(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C18A C 0.2146(7) 0.0536(3) 0.4658(5) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C19A C 0.3087(6) 0.0919(3) 0.4521(5) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C20A C 0.2574(8) 0.1471(4) 0.4249(5) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C21A C 0.3070(5) 0.1794(4) 0.3771(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C22A C 0.2236(7) 0.2053(5) 0.3258(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C23A C 0.2427(6) 0.2032(5) 0.2606(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C24A C 0.1261(6) 0.1996(5) 0.2172(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C25A C 0.1189(6) 0.1700(4) 0.1570(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C26A C 0.0051(6) 0.1437(3) 0.1321(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C27A C -0.0854(8) 0.1382(4) 0.1700(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C28A C -0.1474(7) 0.0808(3) 0.1532(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C29A C -0.1908(8) 0.0457(3) 0.1999(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C30A C -0.1874(8) -0.0184(3) 0.1981(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C31A C -0.1643(8) -0.0537(3) 0.2565(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C32A C -0.0943(7) -0.1063(4) 0.2456(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C33A C -0.0012(6) -0.1285(4) 0.2958(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C34A C 0.0090(6) -0.1049(4) 0.3581(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C35A C 0.1221(5) -0.0993(3) 0.4027(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C36A C 0.2275(6) -0.1214(3) 0.3846(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C37A C 0.3372(6) -0.0912(3) 0.4158(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C38A C 0.3314(6) -0.0361(3) 0.4527(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C39A C 0.4246(7) 0.0032(3) 0.4420(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C40A C 0.4183(7) 0.0693(3) 0.4354(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C41A C 0.4752(7) 0.1045(3) 0.3932(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C42A C 0.4167(6) 0.1588(3) 0.3627(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C43A C 0.4400(7) 0.1616(3) 0.2974(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C44A C 0.3479(7) 0.1803(4) 0.2445(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C45A C 0.3490(7) 0.1480(3) 0.1847(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C46A C 0.2287(6) 0.1454(4) 0.1370(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C47A C 0.2141(8) 0.0962(3) 0.0939(5) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C48A C 0.0979(5) 0.0702(3) 0.0716(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C49A C -0.0004(6) 0.0905(3) 0.0914(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C50A C -0.0942(6) 0.0518(3) 0.1052(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C51A C -0.0829(7) -0.0133(4) 0.1040(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C52A C -0.1328(8) -0.0485(3) 0.1503(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C53A C -0.0804(6) -0.1043(3) 0.1800(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C54A C 0.0195(5) -0.1298(3) 0.1639(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C55A C 0.1142(6) -0.1540(4) 0.2054(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C56A C 0.1083(6) -0.1531(4) 0.2743(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C57A C 0.2221(6) -0.1488(4) 0.3191(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C58A C 0.3315(7) -0.1466(4) 0.2930(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C59A C 0.4350(6) -0.1126(3) 0.3268(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C60A C 0.4342(6) -0.0865(3) 0.3845(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C61A C 0.4902(7) -0.0260(3) 0.4008(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C62A C 0.5499(8) 0.0117(3) 0.3458(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C63A C 0.5386(7) 0.0761(3) 0.3475(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C64A C 0.5152(7) 0.1117(3) 0.2888(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C65A C 0.5092(8) 0.0830(3) 0.2294(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C66A C 0.4378(7) 0.0998(3) 0.1816(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C67A C 0.4057(6) 0.0508(3) 0.1365(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C68A C 0.3005(5) 0.0483(3) 0.0949(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C69A C 0.2386(6) -0.0077(3) 0.0822(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C70A C 0.1110(6) 0.0050(3) 0.0669(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C71A C 0.0252(6) -0.0362(4) 0.0838(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C72A C 0.0670(6) -0.0938(4) 0.1111(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C73A C 0.1946(5) -0.1063(3) 0.1247(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C74A C 0.2246(5) -0.1441(4) 0.1806(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C75A C 0.3273(6) -0.1417(3) 0.2254(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C76A C 0.4204(6) -0.0997(3) 0.2151(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C77A C 0.4879(7) -0.0821(4) 0.2757(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C78A C 0.5430(8) -0.0166(3) 0.2835(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C79A C 0.5249(8) 0.0156(3) 0.2244(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C80A C 0.4600(7) -0.0009(3) 0.1702(3) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C81A C 0.4007(7) -0.0593(3) 0.1607(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C82A C 0.2829(6) -0.0622(3) 0.1127(4) 0.0220(3) Uani 0.368(2) 1 d PD A 2
C3B C -0.1409(11) 0.1419(5) 0.2725(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C4B C -0.0575(9) 0.1702(6) 0.2357(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C5B C 0.0517(9) 0.2041(6) 0.2612(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C6B C 0.0972(9) 0.2035(7) 0.3319(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C7B C 0.1306(8) 0.1371(5) 0.4297(7) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C8B C 0.0889(8) 0.0769(4) 0.4495(6) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C9B C -0.0220(10) 0.0492(4) 0.4140(7) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C10B C -0.1107(12) 0.0812(4) 0.3662(7) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C11B C -0.1622(17) 0.0428(5) 0.3114(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C12B C -0.1798(15) 0.0809(4) 0.2557(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C13B C -0.1809(11) 0.0549(4) 0.1925(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C14B C -0.1288(10) 0.0880(4) 0.1479(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C15B C -0.0663(10) 0.1436(6) 0.1709(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C16B C 0.0313(7) 0.1489(5) 0.1362(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C17B C 0.1394(8) 0.1774(5) 0.1630(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C18B C 0.1487(7) 0.2052(6) 0.2256(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C19B C 0.2580(8) 0.2054(6) 0.2730(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C20B C 0.2258(9) 0.2001(7) 0.3345(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C21B C 0.3096(6) 0.1710(5) 0.3854(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C22B C 0.2571(9) 0.1398(6) 0.4314(7) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C23B C 0.3023(9) 0.0818(4) 0.4556(7) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C24B C 0.2024(8) 0.0437(4) 0.4647(7) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C25B C 0.2054(7) -0.0199(4) 0.4555(6) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C26B C 0.0944(7) -0.0511(4) 0.4357(6) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C27B C -0.0107(10) -0.0146(4) 0.4137(7) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C28B C -0.0814(10) -0.0485(4) 0.3596(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C29B C -0.1597(11) -0.0218(5) 0.3060(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C30B C -0.1749(11) -0.0476(4) 0.2436(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C31B C -0.1825(11) -0.0099(4) 0.1874(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C32B C -0.1265(10) -0.0402(4) 0.1399(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C33B C -0.0587(8) -0.0063(4) 0.1021(6) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C34B C -0.0651(8) 0.0569(4) 0.1031(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C35B C 0.0328(7) 0.0954(4) 0.0948(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C36B C 0.1394(7) 0.0688(3) 0.0825(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C37B C 0.2462(7) 0.1058(4) 0.1035(6) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C38B C 0.2441(7) 0.1558(5) 0.1480(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C39B C 0.3563(8) 0.1639(4) 0.1908(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C40B C 0.3690(9) 0.1819(5) 0.2587(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C41B C 0.4480(9) 0.1535(5) 0.3116(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C42B C 0.4227(7) 0.1494(5) 0.3764(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C43B C 0.4707(10) 0.0919(4) 0.4040(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C44B C 0.4062(9) 0.0555(4) 0.4419(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C45B C 0.4224(9) -0.0084(4) 0.4295(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C46B C 0.3175(8) -0.0478(4) 0.4401(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C47B C 0.3085(8) -0.1045(4) 0.4092(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C48B C 0.1928(7) -0.1307(4) 0.3873(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C49B C 0.0906(7) -0.1062(4) 0.3985(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C50B C -0.0196(8) -0.1039(5) 0.3511(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C51B C -0.0293(8) -0.1304(5) 0.2877(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C52B C -0.1089(10) -0.1015(5) 0.2340(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C53B C -0.0847(8) -0.0967(5) 0.1693(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C54B C 0.0147(8) -0.1227(4) 0.1529(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C55B C 0.0870(8) -0.0981(5) 0.1160(6) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C56B C 0.0536(7) -0.0373(4) 0.0903(6) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C57B C 0.1506(7) 0.0010(4) 0.0792(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C58B C 0.2722(7) -0.0228(4) 0.0955(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C59B C 0.3742(8) 0.0162(4) 0.1206(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C60B C 0.3565(7) 0.0766(4) 0.1248(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C61B C 0.4250(10) 0.1133(4) 0.1794(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C62B C 0.5170(11) 0.0770(4) 0.2401(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C63B C 0.5267(10) 0.1034(4) 0.3027(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C64B C 0.5380(10) 0.0665(4) 0.3603(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C65B C 0.5432(10) 0.0035(4) 0.3551(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C66B C 0.5028(9) -0.0325(4) 0.3887(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C67B C 0.4692(8) -0.0873(4) 0.3530(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C68B C 0.3782(8) -0.1225(4) 0.3623(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C69B C 0.3055(7) -0.1549(5) 0.3110(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C70B C 0.1873(7) -0.1611(5) 0.3258(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C71B C 0.0819(7) -0.1581(5) 0.2761(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C72B C 0.0948(7) -0.1572(6) 0.2100(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C73B C 0.2146(7) -0.1520(7) 0.1966(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C74B C 0.2120(7) -0.1171(5) 0.1392(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C75B C 0.2989(8) -0.0796(5) 0.1273(6) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C76B C 0.4083(9) -0.0753(4) 0.1761(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C77B C 0.4590(11) -0.0175(3) 0.1721(5) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C78B C 0.5268(11) 0.0117(4) 0.2371(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C79B C 0.5387(12) -0.0274(4) 0.2915(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C80B C 0.4967(10) -0.0813(5) 0.2907(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C81B C 0.4252(9) -0.1104(5) 0.2346(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C82B C 0.3222(7) -0.1484(5) 0.2471(4) 0.0198(6) Uani 0.248(3) 1 d PD A 3
C3C C 0.1240(9) 0.1365(5) 0.4308(7) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C4C C 0.0913(9) 0.0738(4) 0.4471(6) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C5C C -0.0250(10) 0.0524(4) 0.4123(7) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C6C C -0.1150(13) 0.0816(4) 0.3619(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C7C C -0.0991(8) 0.1567(5) 0.2751(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C8C C -0.0009(8) 0.1877(5) 0.2504(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C9C C 0.1131(8) 0.2160(5) 0.2809(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C10C C 0.1412(8) 0.2037(7) 0.3507(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C11C C 0.2608(9) 0.1828(5) 0.3812(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C12C C 0.2493(10) 0.1383(6) 0.4288(7) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C13C C 0.3467(8) 0.0955(4) 0.4480(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C14C C 0.3013(7) 0.0392(4) 0.4641(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C15C C 0.1783(7) 0.0247(4) 0.4649(6) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C16C C 0.1556(7) -0.0388(4) 0.4488(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C17C C 0.0445(8) -0.0562(4) 0.4121(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C18C C -0.0488(8) -0.0116(4) 0.3932(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C19C C -0.1332(11) -0.0188(4) 0.3331(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C20C C -0.1694(16) 0.0406(4) 0.3109(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C21C C -0.1901(9) 0.0546(4) 0.2428(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C22C C -0.1446(11) 0.1114(4) 0.2276(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C23C C -0.0976(10) 0.1193(4) 0.1699(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C24C C -0.0052(8) 0.1661(5) 0.1842(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C25C C 0.0885(8) 0.1648(5) 0.1488(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C26C C 0.1945(8) 0.1918(6) 0.1851(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C27C C 0.2105(7) 0.2124(5) 0.2505(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C28C C 0.3340(8) 0.2005(5) 0.2814(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C29C C 0.3576(8) 0.1836(5) 0.3476(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C30C C 0.4505(9) 0.1412(5) 0.3678(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C31C C 0.4473(9) 0.0973(4) 0.4176(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C32C C 0.4997(9) 0.0405(4) 0.4025(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C33C C 0.4502(10) -0.0172(4) 0.4132(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C34C C 0.3578(10) -0.0174(4) 0.4476(6) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C35C C 0.2683(7) -0.0646(4) 0.4375(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C36C C 0.2682(7) -0.1110(4) 0.3909(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C37C C 0.1525(8) -0.1374(5) 0.3621(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C38C C 0.0460(8) -0.1073(4) 0.3744(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C39C C -0.0383(9) -0.1125(4) 0.3151(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C40C C -0.1299(9) -0.0680(4) 0.2875(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C41C C -0.1674(10) -0.0551(4) 0.2199(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C42C C -0.1916(12) 0.0071(4) 0.1975(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C43C C -0.1476(9) 0.0161(4) 0.1382(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C44C C -0.0954(9) 0.0727(4) 0.1251(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C45C C 0.0033(9) 0.0641(4) 0.0922(6) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C46C C 0.0966(7) 0.1151(4) 0.1014(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C47C C 0.2109(9) 0.0996(4) 0.0917(7) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C48C C 0.3157(8) 0.1262(5) 0.1305(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C49C C 0.3090(8) 0.1710(5) 0.1732(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C50C C 0.3936(9) 0.1746(4) 0.2341(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C51C C 0.4837(9) 0.1293(4) 0.2565(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C52C C 0.5173(10) 0.1130(4) 0.3241(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C53C C 0.5489(12) 0.0517(4) 0.3467(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C54C C 0.5577(9) 0.0046(4) 0.3052(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C55C C 0.5180(10) -0.0532(4) 0.3099(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C56C C 0.4622(9) -0.0664(4) 0.3651(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C57C C 0.3687(9) -0.1119(4) 0.3546(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C58C C 0.3429(11) -0.1434(5) 0.2927(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C59C C 0.2237(7) -0.1657(5) 0.2647(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C60C C 0.1373(7) -0.1621(5) 0.2999(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C61C C 0.0134(8) -0.1441(5) 0.2690(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C62C C -0.0193(8) -0.1279(5) 0.1899(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C63C C -0.1102(9) -0.0836(5) 0.1715(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C64C C -0.1026(9) -0.0405(4) 0.1210(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C65C C -0.0075(7) -0.0418(4) 0.0887(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C66C C 0.0411(8) 0.0039(4) 0.0729(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C67C C 0.1635(7) -0.0061(4) 0.0683(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C68C C 0.2448(7) 0.0388(4) 0.0781(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C69C C 0.3614(9) 0.0256(4) 0.1128(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C70C C 0.4097(9) 0.0807(4) 0.1456(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C71C C 0.4886(10) 0.0826(4) 0.2073(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C72C C 0.5321(12) 0.0246(4) 0.2332(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C73C C 0.4869(9) -0.0321(4) 0.2021(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C74C C 0.4782(9) -0.0808(4) 0.2458(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C75C C 0.3931(9) -0.1243(4) 0.2397(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C76C C 0.3071(7) -0.1260(4) 0.1788(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C77C C 0.2023(7) -0.1509(6) 0.1943(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C78C C 0.0781(8) -0.1299(5) 0.1549(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C79C C 0.0880(8) -0.0889(5) 0.1045(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C80C C 0.1852(7) -0.0662(4) 0.0923(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C81C C 0.3027(8) -0.0802(5) 0.1300(5) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C82C C 0.3963(7) -0.0306(4) 0.1426(4) 0.0221(6) Uani 0.234(2) 1 d PD A 4
C11 C -0.058(5) 0.1998(7) 0.392(2) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C12 C -0.003(2) 0.2424(10) 0.4445(11) 0.0255(9) Uani 0.150(2) 1 d P A 5
H12 H 0.0838 0.2324 0.4617 0.031 Uiso 0.150(2) 1 calc PR A 5
C13 C -0.1977(19) 0.2138(10) 0.3708(11) 0.0255(9) Uani 0.150(2) 1 d P A 5
H13 H -0.2350 0.1849 0.3356 0.031 Uiso 0.150(2) 1 calc PR A 5
C14 C -0.262(3) 0.2077(13) 0.4285(14) 0.0255(9) Uani 0.150(2) 1 d P A 5
H14A H -0.2592 0.1648 0.4437 0.031 Uiso 0.150(2) 1 calc PR A 5
H14B H -0.3479 0.2199 0.4149 0.031 Uiso 0.150(2) 1 calc PR A 5
C15 C -0.215(2) 0.2803(11) 0.3451(12) 0.0255(9) Uani 0.150(2) 1 d P A 5
H15A H -0.1761 0.2857 0.3073 0.031 Uiso 0.150(2) 1 calc PR A 5
H15B H -0.3021 0.2895 0.3311 0.031 Uiso 0.150(2) 1 calc PR A 5
C16 C -0.071(4) 0.235(2) 0.492(2) 0.0255(9) Uani 0.150(2) 1 d P A 5
H16A H -0.0295 0.2589 0.5300 0.031 Uiso 0.150(2) 1 calc PR A 5
H16B H -0.0634 0.1916 0.5049 0.031 Uiso 0.150(2) 1 calc PR A 5
C17 C -0.019(2) 0.3103(12) 0.4206(13) 0.0255(9) Uani 0.150(2) 1 d P A 5
H17A H 0.0204 0.3166 0.3830 0.031 Uiso 0.150(2) 1 calc PR A 5
H17B H 0.0188 0.3384 0.4559 0.031 Uiso 0.150(2) 1 calc PR A 5
C18 C -0.1979(19) 0.2500(10) 0.4838(11) 0.0255(9) Uani 0.150(2) 1 d P A 5
H18 H -0.2285 0.2443 0.5249 0.031 Uiso 0.150(2) 1 calc PR A 5
C19 C -0.158(2) 0.3232(10) 0.4004(10) 0.0255(9) Uani 0.150(2) 1 d P A 5
H19 H -0.1702 0.3665 0.3851 0.031 Uiso 0.150(2) 1 calc PR A 5
C20 C -0.209(3) 0.3154(15) 0.4601(17) 0.0255(9) Uani 0.150(2) 1 d P A 5
H20A H -0.2955 0.3272 0.4503 0.031 Uiso 0.150(2) 1 calc PR A 5
H20B H -0.1668 0.3427 0.4948 0.031 Uiso 0.150(2) 1 calc PR A 5
C1D C -0.0343(9) 0.1327(6) 0.3990(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C2D C 0.0086(9) 0.2017(5) 0.3366(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C3D C 0.0813(10) 0.1090(6) 0.4421(8) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C4D C 0.2042(11) 0.1289(6) 0.4392(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C5D C 0.2273(10) 0.1753(7) 0.3940(8) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C6D C 0.1333(10) 0.2050(9) 0.3461(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C7D C -0.0517(12) 0.1755(6) 0.2693(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C8D C -0.1361(15) 0.1233(6) 0.2540(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C9D C -0.1581(15) 0.0769(5) 0.2999(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C10D C -0.1065(18) 0.0839(5) 0.3687(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C11D C -0.0558(12) 0.0285(6) 0.4007(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C12D C 0.0559(11) 0.0449(5) 0.4410(9) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C13D C 0.1498(10) -0.0001(5) 0.4588(8) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C14D C 0.2711(9) 0.0181(5) 0.4704(9) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C15D C 0.2939(11) 0.0815(6) 0.4598(10) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C16D C 0.4045(14) 0.0834(6) 0.4358(8) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C17D C 0.4318(12) 0.1256(6) 0.3914(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C18D C 0.3402(13) 0.1709(7) 0.3712(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C19D C 0.3175(11) 0.1963(7) 0.3071(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C20D C 0.1928(10) 0.2095(9) 0.2916(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C21D C 0.1284(11) 0.2044(10) 0.2258(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C22D C 0.0073(11) 0.1858(8) 0.2162(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C23D C -0.0414(13) 0.1449(7) 0.1647(8) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C24D C -0.1246(16) 0.1050(5) 0.1889(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C25D C -0.1435(14) 0.0449(5) 0.1648(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C26D C -0.1874(17) 0.0035(5) 0.2065(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C27D C -0.1801(16) 0.0185(5) 0.2734(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C28D C -0.1422(17) -0.0354(5) 0.3123(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C29D C -0.0785(12) -0.0321(5) 0.3774(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C30D C 0.0112(12) -0.0765(5) 0.3953(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C31D C 0.1239(10) -0.0606(6) 0.4357(9) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C32D C 0.2181(10) -0.1014(6) 0.4250(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C33D C 0.3344(11) -0.0773(6) 0.4247(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C34D C 0.3637(13) -0.0192(6) 0.4493(9) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C35D C 0.4478(15) 0.0214(5) 0.4290(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C36D C 0.5095(14) -0.0006(5) 0.3818(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C37D C 0.542(2) 0.0494(5) 0.3435(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C38D C 0.5047(13) 0.1119(6) 0.3486(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C39D C 0.4835(13) 0.1367(7) 0.2853(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C40D C 0.3813(13) 0.1754(8) 0.2580(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C41D C 0.3186(12) 0.1780(7) 0.1921(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C42D C 0.1908(10) 0.1907(9) 0.1758(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C43D C 0.1387(11) 0.1510(6) 0.1225(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C44D C 0.0225(11) 0.1245(6) 0.1187(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C45D C 0.0131(13) 0.0645(5) 0.0903(9) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C46D C -0.0811(13) 0.0243(5) 0.1122(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C47D C -0.0597(14) -0.0384(5) 0.1111(8) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C48D C -0.0976(14) -0.0804(5) 0.1547(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C49D C -0.1508(14) -0.0592(6) 0.2019(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C50D C -0.1303(12) -0.0827(7) 0.2670(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C51D C -0.0335(13) -0.1248(8) 0.2889(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C52D C 0.0362(12) -0.1255(7) 0.3544(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C53D C 0.1634(10) -0.1394(9) 0.3729(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C54D C 0.2249(10) -0.1600(7) 0.3275(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C55D C 0.3393(12) -0.1432(8) 0.3261(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C56D C 0.4016(13) -0.1008(6) 0.3748(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C57D C 0.4869(12) -0.0623(6) 0.3515(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C58D C 0.5083(16) -0.0683(6) 0.2862(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C59D C 0.5374(15) -0.0160(5) 0.2503(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C60D C 0.5519(15) 0.0390(5) 0.2793(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C61D C 0.5098(16) 0.0939(6) 0.2402(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C62D C 0.4356(13) 0.0880(5) 0.1631(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C63D C 0.3458(12) 0.1333(6) 0.1460(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C64D C 0.2331(10) 0.1167(6) 0.1047(9) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C65D C 0.2126(10) 0.0590(5) 0.0779(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C66D C 0.1142(10) 0.0346(5) 0.0690(8) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C67D C 0.1260(10) -0.0302(5) 0.0743(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C68D C 0.0441(10) -0.0655(5) 0.0937(8) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C69D C 0.0811(10) -0.1177(7) 0.1315(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C70D C -0.0026(12) -0.1246(9) 0.1744(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C71D C 0.0254(11) -0.1490(7) 0.2384(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C72D C 0.1472(10) -0.1688(8) 0.2588(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C73D C 0.2379(9) -0.1583(8) 0.2205(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C74D C 0.3544(12) -0.1463(7) 0.2587(6) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C75D C 0.4314(14) -0.1060(8) 0.2416(5) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C76D C 0.4111(11) -0.0831(6) 0.1757(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C77D C 0.4708(15) -0.0267(5) 0.1825(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C78D C 0.4142(12) 0.0270(5) 0.1382(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C79D C 0.3064(10) 0.0110(5) 0.0952(8) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C80D C 0.2512(10) -0.0401(6) 0.0935(8) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C81D C 0.2942(10) -0.0908(6) 0.1355(8) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C82D C 0.2021(10) -0.1314(6) 0.1565(7) 0.0255(9) Uani 0.150(2) 1 d PD A 5
C1SA C 0.8897(3) 0.2338(2) 0.0159(2) 0.0290(10) Uani 0.897(10) 1 d PDU B 6
C2SA C 0.7130(12) 0.2670(7) 0.1563(8) 0.032(2) Uani 0.624(18) 1 d PDU C 6
C3S C 0.5000 0.0000 0.0000 0.098(4) Uani 1 2 d SU . .
S1A S 0.7766(3) 0.19250(11) 0.00257(14) 0.0418(5) Uani 0.897(10) 1 d PDU B 6
S2A S 1.00182(11) 0.27555(12) 0.02982(11) 0.0400(6) Uani 0.897(10) 1 d PDU B 6
S3A S 0.8019(4) 0.31842(17) 0.1488(5) 0.0592(15) Uani 0.624(18) 1 d PDU C 6
S4A S 0.6234(8) 0.2161(4) 0.1640(4) 0.0362(12) Uani 0.624(18) 1 d PDU C 6
S5A S 0.60530(15) 0.04644(13) 0.03613(8) 0.0666(6) Uani 0.75 1 d PU D 6
C1SB C 0.868(3) 0.214(2) 0.005(3) 0.046(8) Uani 0.103(10) 1 d PDU B 7
S1B S 0.756(2) 0.1764(18) 0.0116(18) 0.085(9) Uani 0.103(10) 1 d PDU B 7
S2B S 0.988(2) 0.2481(16) 0.0075(14) 0.072(6) Uani 0.103(10) 1 d PDU B 7
C2SB C 0.703(2) 0.2777(11) 0.1406(13) 0.042(5) Uani 0.376(18) 1 d PDU C 7
S3B S 0.7653(9) 0.3308(4) 0.1120(8) 0.062(3) Uani 0.376(18) 1 d PDU C 7
S4B S 0.6411(14) 0.2245(6) 0.1689(8) 0.047(2) Uani 0.376(18) 1 d PDU C 7
S5B S 0.6176(4) -0.0065(4) 0.0467(2) 0.0617(16) Uani 0.25 1 d PU D 7
Sc1 Sc 0.06215(6) 0.10047(3) 0.32359(3) 0.02403(16) Uani 1 1 d . E 1
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sc Sc 0.2519 0.3716 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
C1A C1 C2A 90.1(2) . .
C1A C1 C3 114.0(5) . .
C2A C1 C3 114.4(3) . .
C1A C1 C2 113.2(3) . .
C2A C1 C2 115.3(5) . .
C3 C1 C2 108.9(3) . .
C6 C2 C7 109.6(3) . .
C6 C2 C1 108.6(4) . .
C7 C2 C1 110.8(4) . .
C6 C2 H2 109.3 . .
C7 C2 H2 109.3 . .
C1 C2 H2 109.3 . .
C5 C3 C4 109.8(3) . .
C5 C3 C1 109.6(4) . .
C4 C3 C1 108.5(4) . .
C5 C3 H3 109.7 . .
C4 C3 H3 109.7 . .
C1 C3 H3 109.7 . .
C8 C4 C3 109.9(3) . .
C8 C4 H4A 109.7 . .
C3 C4 H4A 109.7 . .
C8 C4 H4B 109.7 . .
C3 C4 H4B 109.7 . .
H4A C4 H4B 108.2 . .
C3 C5 C9 110.0(3) . .
C3 C5 H5A 109.7 . .
C9 C5 H5A 109.7 . .
C3 C5 H5B 109.7 . .
C9 C5 H5B 109.7 . .
H5A C5 H5B 108.2 . .
C8 C6 C2 110.1(3) . .
C8 C6 H6A 109.6 . .
C2 C6 H6A 109.6 . .
C8 C6 H6B 109.6 . .
C2 C6 H6B 109.6 . .
H6A C6 H6B 108.2 . .
C9 C7 C2 108.0(4) . .
C9 C7 H7A 110.1 . .
C2 C7 H7A 110.1 . .
C9 C7 H7B 110.1 . .
C2 C7 H7B 110.1 . .
H7A C7 H7B 108.4 . .
C6 C8 C4 108.2(3) . .
C6 C8 C10 109.4(3) . .
C4 C8 C10 110.8(4) . .
C6 C8 H8 109.5 . .
C4 C8 H8 109.5 . .
C10 C8 H8 109.5 . .
C10 C9 C7 110.1(4) . .
C10 C9 C5 109.1(4) . .
C7 C9 C5 110.1(4) . .
C10 C9 H9 109.2 . .
C7 C9 H9 109.2 . .
C5 C9 H9 109.2 . .
C9 C10 C8 109.0(3) . .
C9 C10 H10A 109.9 . .
C8 C10 H10A 109.9 . .
C9 C10 H10B 109.9 . .
C8 C10 H10B 109.9 . .
H10A C10 H10B 108.3 . .
C6C C1A C10A 96.7(6) . .
C6C C1A C10B 3.7(7) . .
C10A C1A C10B 100.1(8) . .
C6C C1A C1 130.5(5) . .
C10A C1A C1 132.4(5) . .
C10B C1A C1 126.9(6) . .
C6C C1A C3B 102.4(6) . .
C10A C1A C3B 5.9(8) . .
C10B C1A C3B 105.8(7) . .
C1 C1A C3B 126.9(5) . .
C6C C1A C3A 9.1(5) . .
C10A C1A C3A 105.2(5) . .
C10B C1A C3A 5.5(7) . .
C1 C1A C3A 121.6(4) . .
C3B C1A C3A 110.9(7) . .
C6C C1A C7C 115.2(7) . .
C10A C1A C7C 24.2(4) . .
C10B C1A C7C 118.1(8) . .
C1 C1A C7C 110.9(4) . .
C3B C1A C7C 21.2(5) . .
C3A C1A C7C 122.3(6) . .
C6A C2A C6B 112.1(8) . .
C6A C2A C10C 93.6(6) . .
C6B C2A C10C 23.3(5) . .
C6A C2A C1 126.6(4) . .
C6B C2A C1 118.9(5) . .
C10C C2A C1 139.6(5) . .
C6A C2A C3C 8.1(5) . .
C6B C2A C3C 117.2(7) . .
C10C C2A C3C 100.3(6) . .
C1 C2A C3C 119.6(5) . .
C6A C2A C7B 5.6(6) . .
C6B C2A C7B 114.4(8) . .
C10C C2A C7B 97.2(7) . .
C1 C2A C7B 122.7(5) . .
C3C C2A C7B 3.1(6) . .
C6A C2A C7A 114.2(5) . .
C6B C2A C7A 2.3(7) . .
C10C C2A C7A 25.4(4) . .
C1 C2A C7A 116.6(4) . .
C3C C2A C7A 119.2(7) . .
C7B C2A C7A 116.4(7) . .
C12A C3A C4A 117.4(8) . .
C12A C3A C1A 104.7(6) . .
C4A C3A C1A 129.1(7) . .
C15A C4A C5A 117.0(8) . .
C15A C4A C3A 115.6(7) . .
C5A C4A C3A 117.7(8) . .
C18A C5A C4A 119.1(7) . .
C18A C5A C6A 106.3(4) . .
C4A C5A C6A 128.6(7) . .
C2A C6A C20A 119.8(6) . .
C2A C6A C5A 126.3(6) . .
C20A C6A C5A 107.5(4) . .
C22A C7A C8A 107.8(4) . .
C22A C7A C2A 117.6(6) . .
C8A C7A C2A 128.5(6) . .
C24A C8A C9A 117.9(6) . .
C24A C8A C7A 106.2(4) . .
C9A C8A C7A 127.7(7) . .
C27A C9A C10A 118.6(7) . .
C27A C9A C8A 115.9(7) . .
C10A C9A C8A 117.8(7) . .
C1A C10A C11A 109.9(7) . .
C1A C10A C9A 127.6(7) . .
C11A C10A C9A 115.9(8) . .
C12A C11A C29A 122.4(9) . .
C12A C11A C10A 106.3(10) . .
C29A C11A C10A 125.9(7) . .
C11A C12A C3A 111.0(10) . .
C11A C12A C13A 119.2(9) . .
C3A C12A C13A 124.6(8) . .
C14A C13A C31A 117.5(7) . .
C14A C13A C12A 117.7(7) . .
C31A C13A C12A 118.3(7) . .
C13A C14A C15A 119.0(7) . .
C13A C14A C34A 121.2(7) . .
C15A C14A C34A 108.0(4) . .
C14A C15A C16A 108.5(4) . .
C14A C15A C4A 124.4(7) . .
C16A C15A C4A 120.5(7) . .
C17A C16A C15A 123.3(7) . .
C17A C16A C35A 119.7(6) . .
C15A C16A C35A 107.5(4) . .
C38A C17A C16A 118.0(6) . .
C38A C17A C18A 119.2(7) . .
C16A C17A C18A 116.4(7) . .
C19A C18A C17A 119.8(7) . .
C19A C18A C5A 108.3(4) . .
C17A C18A C5A 123.5(7) . .
C20A C19A C18A 108.7(5) . .
C20A C19A C40A 119.9(7) . .
C18A C19A C40A 124.1(7) . .
C19A C20A C21A 121.3(8) . .
C19A C20A C6A 108.5(4) . .
C21A C20A C6A 123.4(8) . .
C22A C21A C42A 116.9(7) . .
C22A C21A C20A 116.1(6) . .
C42A C21A C20A 118.7(7) . .
C21A C22A C23A 120.9(7) . .
C21A C22A C7A 122.6(7) . .
C23A C22A C7A 109.1(4) . .
C44A C23A C22A 123.1(7) . .
C44A C23A C24A 122.9(6) . .
C22A C23A C24A 108.1(4) . .
C25A C24A C23A 118.1(7) . .
C25A C24A C8A 125.7(7) . .
C23A C24A C8A 108.6(4) . .
C24A C25A C26A 113.7(6) . .
C24A C25A C46A 121.3(7) . .
C26A C25A C46A 120.0(6) . .
C25A C26A C27A 122.3(7) . .
C25A C26A C49A 118.4(6) . .
C27A C26A C49A 108.3(4) . .
C9A C27A C26A 123.7(7) . .
C9A C27A C28A 122.0(7) . .
C26A C27A C28A 107.8(4) . .
C29A C28A C50A 120.4(7) . .
C29A C28A C27A 121.6(7) . .
C50A C28A C27A 107.8(4) . .
C30A C29A C28A 120.7(7) . .
C30A C29A C11A 117.7(7) . .
C28A C29A C11A 114.7(7) . .
C29A C30A C31A 121.3(8) . .
C29A C30A C52A 119.6(6) . .
C31A C30A C52A 108.7(5) . .
C13A C31A C30A 120.8(8) . .
C13A C31A C32A 120.9(7) . .
C30A C31A C32A 108.0(4) . .
C33A C32A C53A 121.4(7) . .
C33A C32A C31A 120.5(7) . .
C53A C32A C31A 107.5(4) . .
C34A C33A C32A 118.7(7) . .
C34A C33A C56A 119.9(6) . .
C32A C33A C56A 115.9(7) . .
C33A C34A C35A 122.8(6) . .
C33A C34A C14A 120.1(7) . .
C35A C34A C14A 107.3(4) . .
C36A C35A C34A 119.3(6) . .
C36A C35A C16A 123.0(6) . .
C34A C35A C16A 108.7(4) . .
C35A C36A C37A 114.8(6) . .
C35A C36A C57A 120.5(6) . .
C37A C36A C57A 118.3(6) . .
C60A C37A C38A 108.5(4) . .
C60A C37A C36A 120.6(6) . .
C38A C37A C36A 119.9(6) . .
C17A C38A C39A 119.3(7) . .
C17A C38A C37A 123.4(6) . .
C39A C38A C37A 107.8(4) . .
C61A C39A C38A 109.1(4) . .
C61A C39A C40A 114.6(6) . .
C38A C39A C40A 126.5(7) . .
C41A C40A C19A 119.0(7) . .
C41A C40A C39A 125.3(7) . .
C19A C40A C39A 110.3(6) . .
C40A C41A C42A 119.7(7) . .
C40A C41A C63A 121.8(6) . .
C42A C41A C63A 107.7(4) . .
C21A C42A C41A 120.9(6) . .
C21A C42A C43A 121.7(7) . .
C41A C42A C43A 107.4(4) . .
C64A C43A C44A 119.1(7) . .
C64A C43A C42A 108.4(4) . .
C44A C43A C42A 120.4(7) . .
C23A C44A C43A 116.2(7) . .
C23A C44A C45A 123.0(7) . .
C43A C44A C45A 113.9(7) . .
C44A C45A C66A 121.2(7) . .
C44A C45A C46A 115.3(6) . .
C66A C45A C46A 118.3(6) . .
C47A C46A C25A 117.7(6) . .
C47A C46A C45A 115.4(6) . .
C25A C46A C45A 119.2(6) . .
C46A C47A C48A 120.1(6) . .
C46A C47A C68A 124.4(8) . .
C48A C47A C68A 107.3(4) . .
C49A C48A C47A 122.5(6) . .
C49A C48A C70A 116.9(6) . .
C47A C48A C70A 108.5(4) . .
C48A C49A C50A 124.3(7) . .
C48A C49A C26A 120.9(6) . .
C50A C49A C26A 107.6(4) . .
C28A C50A C51A 120.6(7) . .
C28A C50A C49A 108.5(4) . .
C51A C50A C49A 120.8(6) . .
C50A C51A C52A 118.1(7) . .
C50A C51A C71A 115.4(6) . .
C52A C51A C71A 118.6(7) . .
C30A C52A C51A 120.5(7) . .
C30A C52A C53A 106.4(4) . .
C51A C52A C53A 124.0(7) . .
C54A C53A C32A 119.2(7) . .
C54A C53A C52A 121.9(7) . .
C32A C53A C52A 109.2(4) . .
C55A C54A C53A 126.4(7) . .
C55A C54A C72A 108.5(4) . .
C53A C54A C72A 113.3(6) . .
C54A C55A C56A 116.4(6) . .
C54A C55A C74A 109.8(5) . .
C56A C55A C74A 124.3(7) . .
C57A C56A C55A 115.6(6) . .
C57A C56A C33A 117.9(7) . .
C55A C56A C33A 120.5(7) . .
C56A C57A C58A 118.5(6) . .
C56A C57A C36A 119.5(6) . .
C58A C57A C36A 117.1(6) . .
C75A C58A C59A 108.2(4) . .
C75A C58A C57A 121.5(7) . .
C59A C58A C57A 120.1(6) . .
C60A C59A C58A 120.6(6) . .
C60A C59A C77A 122.4(6) . .
C58A C59A C77A 106.4(4) . .
C59A C60A C37A 123.0(6) . .
C59A C60A C61A 120.7(6) . .
C37A C60A C61A 107.5(4) . .
C39A C61A C60A 107.1(4) . .
C39A C61A C62A 122.7(6) . .
C60A C61A C62A 119.9(6) . .
C63A C62A C78A 117.6(7) . .
C63A C62A C61A 115.1(6) . .
C78A C62A C61A 117.5(6) . .
C62A C63A C64A 121.4(7) . .
C62A C63A C41A 120.2(6) . .
C64A C63A C41A 107.7(4) . .
C65A C64A C43A 122.8(7) . .
C65A C64A C63A 119.6(7) . .
C43A C64A C63A 108.6(4) . .
C66A C65A C64A 120.8(7) . .
C66A C65A C79A 108.1(5) . .
C64A C65A C79A 121.7(7) . .
C65A C66A C67A 111.1(5) . .
C65A C66A C45A 122.0(7) . .
C67A C66A C45A 118.9(6) . .
C68A C67A C80A 122.7(6) . .
C68A C67A C66A 122.8(6) . .
C80A C67A C66A 104.0(4) . .
C67A C68A C69A 120.4(6) . .
C67A C68A C47A 120.0(6) . .
C69A C68A C47A 108.7(4) . .
C82A C69A C68A 122.4(6) . .
C82A C69A C70A 121.1(6) . .
C68A C69A C70A 108.3(4) . .
C71A C70A C48A 121.7(6) . .
C71A C70A C69A 121.9(6) . .
C48A C70A C69A 106.7(4) . .
C70A C71A C72A 118.1(6) . .
C70A C71A C51A 120.7(7) . .
C72A C71A C51A 114.5(7) . .
C71A C72A C73A 119.0(7) . .
C71A C72A C54A 127.2(7) . .
C73A C72A C54A 104.0(4) . .
C74A C73A C72A 109.7(4) . .
C74A C73A C82A 118.2(6) . .
C72A C73A C82A 122.7(6) . .
C75A C74A C73A 125.8(7) . .
C75A C74A C55A 116.0(6) . .
C73A C74A C55A 107.5(4) . .
C74A C75A C58A 123.2(6) . .
C74A C75A C76A 118.4(6) . .
C58A C75A C76A 108.6(4) . .
C77A C76A C81A 121.8(7) . .
C77A C76A C75A 108.7(4) . .
C81A C76A C75A 120.8(6) . .
C76A C77A C59A 107.8(4) . .
C76A C77A C78A 118.8(7) . .
C59A C77A C78A 123.2(6) . .
C79A C78A C62A 124.0(8) . .
C79A C78A C77A 112.7(8) . .
C62A C78A C77A 116.1(6) . .
C80A C79A C78A 126.9(9) . .
C80A C79A C65A 106.6(4) . .
C78A C79A C65A 115.6(7) . .
C79A C80A C67A 109.6(4) . .
C79A C80A C81A 123.0(7) . .
C67A C80A C81A 119.9(6) . .
C76A C81A C80A 116.4(7) . .
C76A C81A C82A 119.0(6) . .
C80A C81A C82A 117.3(6) . .
C69A C82A C73A 116.8(6) . .
C69A C82A C81A 117.3(6) . .
C73A C82A C81A 117.7(6) . .
C12B C3B C4B 117.5(11) . .
C12B C3B C1A 105.2(8) . .
C4B C3B C1A 119.7(7) . .
C5B C4B C15B 116.1(8) . .
C5B C4B C3B 127.7(8) . .
C15B C4B C3B 113.0(8) . .
C18B C5B C4B 119.8(9) . .
C18B C5B C6B 111.9(8) . .
C4B C5B C6B 117.9(8) . .
C2A C6B C20B 118.2(8) . .
C2A C6B C5B 137.0(8) . .
C20B C6B C5B 100.6(7) . .
C22B C7B C8B 113.9(8) . .
C22B C7B C2A 115.3(7) . .
C8B C7B C2A 127.3(6) . .
C24B C8B C9B 122.5(10) . .
C24B C8B C7B 100.7(8) . .
C9B C8B C7B 121.0(8) . .
C27B C9B C10B 121.9(9) . .
C27B C9B C8B 110.3(8) . .
C10B C9B C8B 124.0(8) . .
C1A C10B C9B 128.8(8) . .
C1A C10B C11B 110.0(9) . .
C9B C10B C11B 112.5(11) . .
C29B C11B C12B 121.5(11) . .
C29B C11B C10B 129.1(9) . .
C12B C11B C10B 106.3(12) . .
C11B C12B C3B 111.2(12) . .
C11B C12B C13B 120.0(11) . .
C3B C12B C13B 122.8(9) . .
C14B C13B C31B 117.8(8) . .
C14B C13B C12B 118.8(9) . .
C31B C13B C12B 117.4(8) . .
C13B C14B C15B 117.2(9) . .
C13B C14B C34B 121.1(9) . .
C15B C14B C34B 109.5(8) . .
C14B C15B C16B 105.9(8) . .
C14B C15B C4B 125.7(9) . .
C16B C15B C4B 121.4(8) . .
C17B C16B C15B 122.3(8) . .
C17B C16B C35B 119.0(7) . .
C15B C16B C35B 109.7(8) . .
C38B C17B C16B 119.0(8) . .
C38B C17B C18B 116.8(8) . .
C16B C17B C18B 117.2(8) . .
C19B C18B C17B 122.3(9) . .
C19B C18B C5B 106.4(8) . .
C17B C18B C5B 123.0(8) . .
C20B C19B C18B 106.8(8) . .
C20B C19B C40B 123.8(9) . .
C18B C19B C40B 121.6(8) . .
C19B C20B C21B 117.6(9) . .
C19B C20B C6B 113.8(7) . .
C21B C20B C6B 124.2(9) . .
C22B C21B C42B 116.7(8) . .
C22B C21B C20B 114.9(8) . .
C42B C21B C20B 122.2(9) . .
C21B C22B C23B 120.3(10) . .
C21B C22B C7B 124.4(9) . .
C23B C22B C7B 104.9(8) . .
C44B C23B C22B 123.6(9) . .
C44B C23B C24B 120.5(8) . .
C22B C23B C24B 109.0(9) . .
C25B C24B C23B 120.5(8) . .
C25B C24B C8B 120.6(9) . .
C23B C24B C8B 111.4(8) . .
C24B C25B C26B 118.1(8) . .
C24B C25B C46B 118.4(8) . .
C26B C25B C46B 118.8(7) . .
C25B C26B C27B 117.3(9) . .
C25B C26B C49B 119.4(7) . .
C27B C26B C49B 111.2(8) . .
C9B C27B C26B 128.7(9) . .
C9B C27B C28B 118.4(9) . .
C26B C27B C28B 105.0(8) . .
C29B C28B C50B 119.8(8) . .
C29B C28B C27B 124.8(9) . .
C50B C28B C27B 108.9(8) . .
C30B C29B C28B 121.0(9) . .
C30B C29B C11B 118.4(9) . .
C28B C29B C11B 111.6(9) . .
C29B C30B C31B 120.8(10) . .
C29B C30B C52B 119.6(8) . .
C31B C30B C52B 107.8(8) . .
C13B C31B C30B 121.1(9) . .
C13B C31B C32B 120.6(8) . .
C30B C31B C32B 110.0(8) . .
C53B C32B C33B 121.8(8) . .
C53B C32B C31B 104.8(8) . .
C33B C32B C31B 120.5(9) . .
C34B C33B C32B 118.5(8) . .
C34B C33B C56B 120.0(7) . .
C32B C33B C56B 115.3(8) . .
C33B C34B C35B 122.8(7) . .
C33B C34B C14B 120.5(8) . .
C35B C34B C14B 107.4(7) . .
C36B C35B C34B 119.5(7) . .
C36B C35B C16B 123.6(7) . .
C34B C35B C16B 107.2(7) . .
C35B C36B C37B 114.1(7) . .
C35B C36B C57B 120.2(7) . .
C37B C36B C57B 119.7(7) . .
C60B C37B C38B 105.7(8) . .
C60B C37B C36B 118.8(8) . .
C38B C37B C36B 119.9(8) . .
C17B C38B C39B 121.3(8) . .
C17B C38B C37B 122.6(7) . .
C39B C38B C37B 112.1(8) . .
C61B C39B C38B 104.6(8) . .
C61B C39B C40B 115.6(8) . .
C38B C39B C40B 123.7(8) . .
C41B C40B C19B 115.5(8) . .
C41B C40B C39B 124.6(8) . .
C19B C40B C39B 112.4(8) . .
C40B C41B C42B 123.2(8) . .
C40B C41B C63B 122.5(8) . .
C42B C41B C63B 108.5(7) . .
C21B C42B C43B 121.0(8) . .
C21B C42B C41B 117.5(8) . .
C43B C42B C41B 107.6(8) . .
C64B C43B C44B 123.0(8) . .
C64B C43B C42B 106.8(8) . .
C44B C43B C42B 121.1(8) . .
C23B C44B C43B 115.7(8) . .
C23B C44B C45B 125.6(8) . .
C43B C44B C45B 110.1(8) . .
C44B C45B C66B 124.7(8) . .
C44B C45B C46B 113.0(7) . .
C66B C45B C46B 118.6(7) . .
C47B C46B C25B 118.4(7) . .
C47B C46B C45B 114.9(7) . .
C25B C46B C45B 121.5(8) . .
C46B C47B C48B 119.1(7) . .
C46B C47B C68B 124.4(8) . .
C48B C47B C68B 105.4(7) . .
C49B C48B C47B 123.8(8) . .
C49B C48B C70B 117.4(8) . .
C47B C48B C70B 110.3(7) . .
C48B C49B C50B 123.7(8) . .
C48B C49B C26B 120.0(7) . .
C50B C49B C26B 106.0(8) . .
C28B C50B C49B 108.9(8) . .
C28B C50B C51B 120.7(9) . .
C49B C50B C51B 121.6(7) . .
C50B C51B C52B 117.9(8) . .
C50B C51B C71B 114.4(8) . .
C52B C51B C71B 118.5(9) . .
C30B C52B C51B 120.9(8) . .
C30B C52B C53B 106.0(8) . .
C51B C52B C53B 124.1(8) . .
C54B C53B C32B 118.3(8) . .
C54B C53B C52B 122.0(8) . .
C32B C53B C52B 111.2(8) . .
C55B C54B C53B 127.3(8) . .
C55B C54B C72B 108.1(8) . .
C53B C54B C72B 113.1(8) . .
C54B C55B C56B 115.7(8) . .
C54B C55B C74B 110.9(8) . .
C56B C55B C74B 123.0(8) . .
C57B C56B C55B 116.2(7) . .
C57B C56B C33B 117.6(8) . .
C55B C56B C33B 121.0(8) . .
C56B C57B C58B 118.3(7) . .
C56B C57B C36B 119.7(7) . .
C58B C57B C36B 115.7(7) . .
C75B C58B C59B 105.5(8) . .
C75B C58B C57B 122.1(8) . .
C59B C58B C57B 121.7(7) . .
C60B C59B C58B 119.1(7) . .
C60B C59B C77B 121.5(8) . .
C58B C59B C77B 108.9(8) . .
C59B C60B C37B 124.5(7) . .
C59B C60B C61B 121.5(8) . .
C37B C60B C61B 107.1(7) . .
C39B C61B C60B 109.7(8) . .
C39B C61B C62B 121.7(8) . .
C60B C61B C62B 118.6(7) . .
C63B C62B C78B 116.9(8) . .
C63B C62B C61B 115.6(7) . .
C78B C62B C61B 118.7(7) . .
C62B C63B C64B 121.9(9) . .
C62B C63B C41B 119.4(8) . .
C64B C63B C41B 105.6(8) . .
C65B C64B C43B 118.5(8) . .
C65B C64B C63B 119.3(9) . .
C43B C64B C63B 110.9(8) . .
C66B C65B C64B 125.1(9) . .
C66B C65B C79B 106.3(7) . .
C64B C65B C79B 121.9(8) . .
C65B C66B C67B 109.5(8) . .
C65B C66B C45B 117.5(9) . .
C67B C66B C45B 118.5(7) . .
C68B C67B C80B 120.8(8) . .
C68B C67B C66B 122.9(7) . .
C80B C67B C66B 108.9(8) . .
C67B C68B C69B 121.9(7) . .
C67B C68B C47B 119.3(7) . .
C69B C68B C47B 110.2(8) . .
C82B C69B C68B 120.7(7) . .
C82B C69B C70B 121.9(8) . .
C68B C69B C70B 107.9(8) . .
C71B C70B C69B 121.2(8) . .
C71B C70B C48B 120.9(8) . .
C69B C70B C48B 106.0(7) . .
C70B C71B C72B 118.7(8) . .
C70B C71B C51B 121.5(8) . .
C72B C71B C51B 114.6(8) . .
C71B C72B C73B 118.4(8) . .
C71B C72B C54B 127.1(9) . .
C73B C72B C54B 103.8(7) . .
C74B C73B C72B 110.3(8) . .
C74B C73B C82B 117.5(8) . .
C72B C73B C82B 123.1(8) . .
C75B C74B C73B 126.5(9) . .
C75B C74B C55B 117.6(8) . .
C73B C74B C55B 106.7(8) . .
C74B C75B C58B 121.9(8) . .
C74B C75B C76B 117.7(8) . .
C58B C75B C76B 110.5(9) . .
C77B C76B C81B 123.6(9) . .
C77B C76B C75B 108.6(8) . .
C81B C76B C75B 121.5(8) . .
C76B C77B C59B 106.2(8) . .
C76B C77B C78B 116.9(8) . .
C59B C77B C78B 124.4(8) . .
C79B C78B C62B 124.4(9) . .
C79B C78B C77B 114.2(9) . .
C62B C78B C77B 114.6(7) . .
C80B C79B C78B 125.3(10) . .
C80B C79B C65B 112.2(8) . .
C78B C79B C65B 115.5(8) . .
C79B C80B C67B 103.0(8) . .
C79B C80B C81B 124.8(9) . .
C67B C80B C81B 121.7(8) . .
C76B C81B C80B 115.0(9) . .
C76B C81B C82B 118.3(8) . .
C80B C81B C82B 115.7(7) . .
C69B C82B C73B 116.1(7) . .
C69B C82B C81B 119.0(7) . .
C73B C82B C81B 118.2(8) . .
C12C C3C C4C 109.2(9) . .
C12C C3C C2A 111.0(8) . .
C4C C3C C2A 132.3(8) . .
C5C C4C C15C 113.1(9) . .
C5C C4C C3C 115.3(9) . .
C15C C4C C3C 123.7(9) . .
C4C C5C C6C 131.0(9) . .
C4C C5C C18C 122.9(10) . .
C6C C5C C18C 99.1(8) . .
C1A C6C C20C 117.3(8) . .
C1A C6C C5C 123.0(7) . .
C20C C6C C5C 113.5(10) . .
C22C C7C C8C 105.3(7) . .
C22C C7C C1A 116.6(7) . .
C8C C7C C1A 129.8(6) . .
C9C C8C C24C 114.4(7) . .
C9C C8C C7C 134.5(7) . .
C24C C8C C7C 107.5(7) . .
C27C C9C C10C 114.8(8) . .
C27C C9C C8C 119.4(8) . .
C10C C9C C8C 110.9(7) . .
C2A C10C C11C 111.5(8) . .
C2A C10C C9C 123.9(7) . .
C11C C10C C9C 119.7(8) . .
C29C C11C C12C 123.3(10) . .
C29C C11C C10C 121.6(8) . .
C12C C11C C10C 108.5(10) . .
C11C C12C C3C 105.8(10) . .
C11C C12C C13C 118.0(10) . .
C3C C12C C13C 133.0(9) . .
C14C C13C C31C 120.1(8) . .
C14C C13C C12C 109.9(8) . .
C31C C13C C12C 119.7(8) . .
C13C C14C C15C 127.1(8) . .
C13C C14C C34C 119.1(8) . .
C15C C14C C34C 106.7(8) . .
C14C C15C C16C 109.8(8) . .
C14C C15C C4C 116.3(8) . .
C16C C15C C4C 124.9(8) . .
C17C C16C C15C 119.5(8) . .
C17C C16C C35C 121.9(8) . .
C15C C16C C35C 106.9(8) . .
C38C C17C C16C 115.3(8) . .
C38C C17C C18C 119.3(8) . .
C16C C17C C18C 120.1(8) . .
C19C C18C C17C 119.5(8) . .
C19C C18C C5C 113.5(9) . .
C17C C18C C5C 119.3(8) . .
C20C C19C C18C 106.8(9) . .
C20C C19C C40C 120.8(8) . .
C18C C19C C40C 124.3(8) . .
C19C C20C C21C 120.2(9) . .
C19C C20C C6C 106.0(8) . .
C21C C20C C6C 124.6(10) . .
C42C C21C C22C 117.0(8) . .
C42C C21C C20C 119.5(9) . .
C22C C21C C20C 114.9(8) . .
C21C C22C C7C 123.5(8) . .
C21C C22C C23C 121.1(8) . .
C7C C22C C23C 111.4(7) . .
C44C C23C C22C 122.9(8) . .
C44C C23C C24C 123.2(8) . .
C22C C23C C24C 106.7(8) . .
C25C C24C C23C 117.6(7) . .
C25C C24C C8C 128.5(8) . .
C23C C24C C8C 108.0(8) . .
C24C C25C C26C 110.8(7) . .
C24C C25C C46C 121.4(8) . .
C26C C25C C46C 120.3(8) . .
C25C C26C C27C 125.5(8) . .
C25C C26C C49C 118.1(8) . .
C27C C26C C49C 108.8(8) . .
C9C C27C C26C 120.4(8) . .
C9C C27C C28C 126.4(8) . .
C26C C27C C28C 107.5(8) . .
C29C C28C C50C 124.0(8) . .
C29C C28C C27C 117.7(8) . .
C50C C28C C27C 108.1(8) . .
C30C C29C C28C 116.9(8) . .
C30C C29C C11C 116.7(8) . .
C28C C29C C11C 118.8(8) . .
C29C C30C C31C 122.6(8) . .
C29C C30C C52C 123.4(8) . .
C31C C30C C52C 105.9(8) . .
C13C C31C C30C 119.5(8) . .
C13C C31C C32C 118.7(8) . .
C30C C31C C32C 110.3(9) . .
C53C C32C C33C 121.3(8) . .
C53C C32C C31C 106.3(8) . .
C33C C32C C31C 122.6(8) . .
C34C C33C C32C 116.7(8) . .
C34C C33C C56C 122.0(8) . .
C32C C33C C56C 116.0(7) . .
C33C C34C C35C 120.7(7) . .
C33C C34C C14C 122.1(9) . .
C35C C34C C14C 108.3(8) . .
C36C C35C C34C 121.6(8) . .
C36C C35C C16C 120.9(8) . .
C34C C35C C16C 108.3(8) . .
C35C C36C C37C 116.8(7) . .
C35C C36C C57C 118.1(7) . .
C37C C36C C57C 120.0(7) . .
C60C C37C C38C 113.3(8) . .
C60C C37C C36C 118.5(8) . .
C38C C37C C36C 117.5(8) . .
C17C C38C C39C 119.2(8) . .
C17C C38C C37C 125.7(8) . .
C39C C38C C37C 104.3(8) . .
C61C C39C C38C 110.1(8) . .
C61C C39C C40C 114.6(8) . .
C38C C39C C40C 126.8(8) . .
C41C C40C C19C 117.9(8) . .
C41C C40C C39C 125.0(8) . .
C19C C40C C39C 110.3(8) . .
C40C C41C C42C 120.6(8) . .
C40C C41C C63C 121.8(8) . .
C42C C41C C63C 105.0(8) . .
C21C C42C C43C 121.5(8) . .
C21C C42C C41C 119.9(8) . .
C43C C42C C41C 109.4(8) . .
C64C C43C C44C 121.8(8) . .
C64C C43C C42C 107.9(8) . .
C44C C43C C42C 120.9(8) . .
C23C C44C C43C 116.3(8) . .
C23C C44C C45C 122.7(8) . .
C43C C44C C45C 111.9(8) . .
C44C C45C C66C 123.2(8) . .
C44C C45C C46C 115.5(7) . .
C66C C45C C46C 117.3(7) . .
C47C C46C C25C 117.4(8) . .
C47C C46C C45C 116.5(8) . .
C25C C46C C45C 119.0(7) . .
C46C C47C C48C 120.7(8) . .
C46C C47C C68C 123.4(9) . .
C48C C47C C68C 105.5(9) . .
C49C C48C C47C 121.9(8) . .
C49C C48C C70C 119.8(8) . .
C47C C48C C70C 109.7(8) . .
C48C C49C C50C 121.1(8) . .
C48C C49C C26C 121.3(9) . .
C50C C49C C26C 106.9(8) . .
C28C C50C C51C 116.9(8) . .
C28C C50C C49C 108.5(8) . .
C51C C50C C49C 123.9(8) . .
C50C C51C C52C 121.7(7) . .
C50C C51C C71C 112.2(8) . .
C52C C51C C71C 118.9(8) . .
C51C C52C C30C 117.0(8) . .
C51C C52C C53C 123.6(8) . .
C30C C52C C53C 108.4(8) . .
C54C C53C C32C 119.3(8) . .
C54C C53C C52C 122.4(8) . .
C32C C53C C52C 108.6(8) . .
C55C C54C C53C 126.2(8) . .
C55C C54C C72C 109.7(8) . .
C53C C54C C72C 112.8(8) . .
C54C C55C C56C 116.6(7) . .
C54C C55C C74C 111.5(8) . .
C56C C55C C74C 123.2(8) . .
C57C C56C C55C 116.0(7) . .
C57C C56C C33C 115.8(8) . .
C55C C56C C33C 120.4(8) . .
C56C C57C C58C 118.6(7) . .
C56C C57C C36C 121.7(8) . .
C58C C57C C36C 115.3(8) . .
C75C C58C C59C 105.7(9) . .
C75C C58C C57C 121.7(8) . .
C59C C58C C57C 122.0(8) . .
C60C C59C C58C 118.8(8) . .
C60C C59C C77C 123.0(8) . .
C58C C59C C77C 106.5(8) . .
C59C C60C C37C 125.0(8) . .
C59C C60C C61C 120.6(8) . .
C37C C60C C61C 103.6(8) . .
C39C C61C C60C 108.6(8) . .
C39C C61C C62C 122.8(7) . .
C60C C61C C62C 119.7(7) . .
C63C C62C C78C 118.2(8) . .
C63C C62C C61C 115.0(7) . .
C78C C62C C61C 117.5(7) . .
C62C C63C C64C 120.3(8) . .
C62C C63C C41C 120.6(8) . .
C64C C63C C41C 109.7(8) . .
C65C C64C C43C 120.1(8) . .
C65C C64C C63C 121.1(8) . .
C43C C64C C63C 107.9(9) . .
C66C C65C C64C 123.6(9) . .
C66C C65C C79C 106.4(8) . .
C64C C65C C79C 120.7(8) . .
C65C C66C C67C 113.0(8) . .
C65C C66C C45C 119.2(8) . .
C67C C66C C45C 119.9(8) . .
C68C C67C C80C 124.5(8) . .
C68C C67C C66C 121.8(8) . .
C80C C67C C66C 102.8(8) . .
C67C C68C C69C 118.4(8) . .
C67C C68C C47C 120.7(8) . .
C69C C68C C47C 110.5(9) . .
C82C C69C C68C 124.4(8) . .
C82C C69C C70C 118.4(8) . .
C68C C69C C70C 107.6(8) . .
C71C C70C C69C 124.7(8) . .
C71C C70C C48C 118.7(8) . .
C69C C70C C48C 106.2(8) . .
C70C C71C C72C 115.3(8) . .
C70C C71C C51C 124.0(8) . .
C72C C71C C51C 114.2(8) . .
C71C C72C C73C 121.7(9) . .
C71C C72C C54C 127.4(8) . .
C73C C72C C54C 100.3(8) . .
C74C C73C C72C 114.5(8) . .
C74C C73C C82C 116.4(8) . .
C72C C73C C82C 119.7(8) . .
C75C C74C C73C 127.6(9) . .
C75C C74C C55C 117.7(8) . .
C73C C74C C55C 103.6(8) . .
C74C C75C C58C 122.0(8) . .
C74C C75C C76C 116.6(8) . .
C58C C75C C76C 112.5(9) . .
C77C C76C C81C 122.0(9) . .
C77C C76C C75C 104.9(8) . .
C81C C76C C75C 122.5(8) . .
C76C C77C C59C 109.8(8) . .
C76C C77C C78C 118.8(8) . .
C59C C77C C78C 122.9(8) . .
C79C C78C C62C 123.2(9) . .
C79C C78C C77C 112.8(8) . .
C62C C78C C77C 116.3(7) . .
C80C C79C C78C 126.8(10) . .
C80C C79C C65C 107.7(8) . .
C78C C79C C65C 116.4(8) . .
C79C C80C C67C 109.7(8) . .
C79C C80C C81C 123.1(8) . .
C67C C80C C81C 118.0(8) . .
C76C C81C C80C 116.1(8) . .
C76C C81C C82C 117.4(8) . .
C80C C81C C82C 119.1(8) . .
C69C C82C C73C 119.5(8) . .
C69C C82C C81C 115.4(7) . .
C73C C82C C81C 119.2(7) . .
C12 C11 C1D 120(4) . .
C12 C11 C2D 111(3) . .
C1D C11 C2D 90.0(4) . .
C12 C11 C13 109.3(13) . .
C1D C11 C13 112(3) . .
C2D C11 C13 114(4) . .
C16 C12 C11 105(2) . .
C16 C12 C17 107(2) . .
C11 C12 C17 111(2) . .
C16 C12 H12 111.4 . .
C11 C12 H12 111.4 . .
C17 C12 H12 111.4 . .
C14 C13 C15 107.9(18) . .
C14 C13 C11 112(2) . .
C15 C13 C11 109.2(17) . .
C14 C13 H13 109.2 . .
C15 C13 H13 109.2 . .
C11 C13 H13 109.2 . .
C13 C14 C18 108(2) . .
C13 C14 H14A 110.1 . .
C18 C14 H14A 110.1 . .
C13 C14 H14B 110.1 . .
C18 C14 H14B 110.1 . .
H14A C14 H14B 108.4 . .
C19 C15 C13 107.8(19) . .
C19 C15 H15A 110.2 . .
C13 C15 H15A 110.2 . .
C19 C15 H15B 110.2 . .
C13 C15 H15B 110.2 . .
H15A C15 H15B 108.5 . .
C12 C16 C18 125(3) . .
C12 C16 H16A 106.1 . .
C18 C16 H16A 106.1 . .
C12 C16 H16B 106.1 . .
C18 C16 H16B 106.1 . .
H16A C16 H16B 106.3 . .
C12 C17 C19 107.5(19) . .
C12 C17 H17A 110.2 . .
C19 C17 H17A 110.2 . .
C12 C17 H17B 110.2 . .
C19 C17 H17B 110.2 . .
H17A C17 H17B 108.5 . .
C16 C18 C20 106(2) . .
C16 C18 C14 105(2) . .
C20 C18 C14 109(2) . .
C16 C18 H18 112.3 . .
C20 C18 H18 112.3 . .
C14 C18 H18 112.3 . .
C20 C19 C15 113(2) . .
C20 C19 C17 107(2) . .
C15 C19 C17 110.1(18) . .
C20 C19 H19 109.0 . .
C15 C19 H19 109.0 . .
C17 C19 H19 109.0 . .
C19 C20 C18 111(2) . .
C19 C20 H20A 109.4 . .
C18 C20 H20A 109.4 . .
C19 C20 H20B 109.4 . .
C18 C20 H20B 109.4 . .
H20A C20 H20B 108.0 . .
C10D C1D C11 128(3) . .
C10D C1D C3D 111.0(13) . .
C11 C1D C3D 121(3) . .
C6D C2D C11 123(3) . .
C6D C2D C7D 113.5(11) . .
C11 C2D C7D 119(3) . .
C12D C3D C4D 118.7(12) . .
C12D C3D C1D 100.3(11) . .
C4D C3D C1D 125.4(11) . .
C5D C4D C15D 119.1(11) . .
C5D C4D C3D 122.2(11) . .
C15D C4D C3D 112.7(10) . .
C4D C5D C18D 117.1(11) . .
C4D C5D C6D 124.0(12) . .
C18D C5D C6D 111.7(11) . .
C2D C6D C20D 120.9(11) . .
C2D C6D C5D 130.9(11) . .
C20D C6D C5D 100.6(12) . .
C22D C7D C8D 109.7(11) . .
C22D C7D C2D 117.5(9) . .
C8D C7D C2D 129.0(7) . .
C24D C8D C9D 119.3(10) . .
C24D C8D C7D 103.8(10) . .
C9D C8D C7D 125.7(10) . .
C27D C9D C10D 119.9(10) . .
C27D C9D C8D 114.5(10) . .
C10D C9D C8D 119.7(10) . .
C1D C10D C11D 106.5(13) . .
C1D C10D C9D 127.3(8) . .
C11D C10D C9D 114.5(12) . .
C29D C11D C12D 121.2(12) . .
C29D C11D C10D 126.5(11) . .
C12D C11D C10D 106.8(14) . .
C11D C12D C3D 114.2(13) . .
C11D C12D C13D 120.4(11) . .
C3D C12D C13D 121.9(11) . .
C14D C13D C31D 116.8(11) . .
C14D C13D C12D 119.8(11) . .
C31D C13D C12D 117.2(10) . .
C13D C14D C15D 116.6(11) . .
C13D C14D C34D 121.6(12) . .
C15D C14D C34D 109.2(12) . .
C14D C15D C16D 106.2(12) . .
C14D C15D C4D 126.7(12) . .
C16D C15D C4D 118.6(11) . .
C17D C16D C15D 125.5(11) . .
C17D C16D C35D 115.3(11) . .
C15D C16D C35D 109.8(12) . .
C38D C17D C16D 122.6(11) . .
C38D C17D C18D 117.0(11) . .
C16D C17D C18D 114.2(11) . .
C19D C18D C17D 121.9(11) . .
C19D C18D C5D 106.3(11) . .
C17D C18D C5D 125.4(11) . .
C20D C19D C18D 106.1(12) . .
C20D C19D C40D 121.4(11) . .
C18D C19D C40D 121.7(11) . .
C19D C20D C21D 119.9(11) . .
C19D C20D C6D 114.1(12) . .
C21D C20D C6D 122.1(12) . .
C22D C21D C42D 116.9(10) . .
C22D C21D C20D 117.0(11) . .
C42D C21D C20D 120.0(12) . .
C21D C22D C23D 120.5(11) . .
C21D C22D C7D 122.1(12) . .
C23D C22D C7D 108.7(11) . .
C44D C23D C22D 123.4(11) . .
C44D C23D C24D 121.1(11) . .
C22D C23D C24D 107.0(12) . .
C25D C24D C23D 119.9(10) . .
C25D C24D C8D 124.0(10) . .
C23D C24D C8D 110.5(11) . .
C24D C25D C26D 114.9(10) . .
C24D C25D C46D 119.1(10) . .
C26D C25D C46D 122.7(10) . .
C25D C26D C27D 120.1(12) . .
C25D C26D C49D 115.1(11) . .
C27D C26D C49D 108.9(12) . .
C9D C27D C26D 125.0(10) . .
C9D C27D C28D 120.7(11) . .
C26D C27D C28D 108.5(12) . .
C29D C28D C50D 125.6(10) . .
C29D C28D C27D 122.6(11) . .
C50D C28D C27D 105.7(12) . .
C30D C29D C28D 115.2(11) . .
C30D C29D C11D 119.0(11) . .
C28D C29D C11D 113.7(11) . .
C29D C30D C31D 120.3(11) . .
C29D C30D C52D 125.2(11) . .
C31D C30D C52D 106.0(12) . .
C13D C31D C30D 121.9(11) . .
C13D C31D C32D 121.4(11) . .
C30D C31D C32D 111.0(11) . .
C53D C32D C33D 118.6(10) . .
C53D C32D C31D 105.2(12) . .
C33D C32D C31D 119.1(12) . .
C34D C33D C32D 119.5(10) . .
C34D C33D C56D 117.1(10) . .
C32D C33D C56D 118.4(10) . .
C33D C34D C35D 125.7(11) . .
C33D C34D C14D 119.4(11) . .
C35D C34D C14D 107.7(11) . .
C36D C35D C34D 116.8(10) . .
C36D C35D C16D 127.7(11) . .
C34D C35D C16D 107.0(12) . .
C35D C36D C37D 110.5(10) . .
C35D C36D C57D 122.9(11) . .
C37D C36D C57D 119.2(10) . .
C60D C37D C38D 108.0(12) . .
C60D C37D C36D 119.4(11) . .
C38D C37D C36D 124.3(11) . .
C17D C38D C39D 121.5(11) . .
C17D C38D C37D 118.8(11) . .
C39D C38D C37D 107.0(13) . .
C61D C39D C38D 111.1(12) . .
C61D C39D C40D 112.4(11) . .
C38D C39D C40D 124.4(11) . .
C41D C40D C19D 117.2(11) . .
C41D C40D C39D 127.4(11) . .
C19D C40D C39D 112.1(10) . .
C40D C41D C42D 121.1(12) . .
C40D C41D C63D 119.3(11) . .
C42D C41D C63D 108.0(12) . .
C21D C42D C43D 121.1(11) . .
C21D C42D C41D 119.5(12) . .
C43D C42D C41D 107.5(13) . .
C64D C43D C44D 120.7(11) . .
C64D C43D C42D 108.0(12) . .
C44D C43D C42D 121.0(11) . .
C23D C44D C43D 115.8(10) . .
C23D C44D C45D 125.1(11) . .
C43D C44D C45D 112.6(11) . .
C44D C45D C66D 122.5(11) . .
C44D C45D C46D 113.5(9) . .
C66D C45D C46D 118.3(10) . .
C47D C46D C25D 114.7(10) . .
C47D C46D C45D 115.4(10) . .
C25D C46D C45D 120.9(10) . .
C46D C47D C48D 123.3(10) . .
C46D C47D C68D 124.5(12) . .
C48D C47D C68D 105.6(11) . .
C49D C48D C47D 119.4(11) . .
C49D C48D C70D 116.2(11) . .
C47D C48D C70D 108.2(13) . .
C48D C49D C50D 124.6(11) . .
C48D C49D C26D 123.8(10) . .
C50D C49D C26D 105.8(12) . .
C28D C50D C49D 110.8(13) . .
C28D C50D C51D 114.8(11) . .
C49D C50D C51D 120.2(11) . .
C50D C51D C52D 123.4(10) . .
C50D C51D C71D 115.5(11) . .
C52D C51D C71D 116.5(10) . .
C30D C52D C51D 115.2(11) . .
C30D C52D C53D 107.6(12) . .
C51D C52D C53D 125.6(11) . .
C54D C53D C32D 121.8(10) . .
C54D C53D C52D 120.2(11) . .
C32D C53D C52D 110.0(12) . .
C55D C54D C53D 123.5(11) . .
C55D C54D C72D 112.3(12) . .
C53D C54D C72D 114.7(11) . .
C54D C55D C56D 119.2(10) . .
C54D C55D C74D 108.0(12) . .
C56D C55D C74D 125.2(10) . .
C57D C56D C55D 113.4(9) . .
C57D C56D C33D 120.4(11) . .
C55D C56D C33D 117.8(10) . .
C56D C57D C58D 121.4(9) . .
C56D C57D C36D 117.0(10) . .
C58D C57D C36D 116.1(10) . .
C75D C58D C59D 107.0(13) . .
C75D C58D C57D 119.0(10) . .
C59D C58D C57D 121.4(11) . .
C60D C59D C58D 119.5(11) . .
C60D C59D C77D 124.5(12) . .
C58D C59D C77D 104.4(12) . .
C59D C60D C37D 124.0(11) . .
C59D C60D C61D 118.7(11) . .
C37D C60D C61D 108.9(13) . .
C39D C61D C60D 104.8(12) . .
C39D C61D C62D 124.8(10) . .
C60D C61D C62D 121.1(10) . .
C63D C62D C78D 119.9(12) . .
C63D C62D C61D 112.8(10) . .
C78D C62D C61D 116.0(11) . .
C62D C63D C64D 119.0(11) . .
C62D C63D C41D 122.8(11) . .
C64D C63D C41D 106.8(12) . .
C65D C64D C43D 121.0(11) . .
C65D C64D C63D 122.1(11) . .
C43D C64D C63D 109.6(12) . .
C66D C65D C64D 122.5(12) . .
C66D C65D C79D 108.4(10) . .
C64D C65D C79D 119.5(11) . .
C65D C66D C67D 110.8(11) . .
C65D C66D C45D 120.4(12) . .
C67D C66D C45D 119.0(11) . .
C68D C67D C80D 123.1(11) . .
C68D C67D C66D 122.8(11) . .
C80D C67D C66D 104.4(12) . .
C67D C68D C69D 119.8(11) . .
C67D C68D C47D 119.8(11) . .
C69D C68D C47D 111.0(12) . .
C82D C69D C68D 123.0(11) . .
C82D C69D C70D 117.5(11) . .
C68D C69D C70D 106.2(12) . .
C71D C70D C69D 125.5(11) . .
C71D C70D C48D 122.2(11) . .
C69D C70D C48D 107.3(11) . .
C70D C71D C72D 114.6(10) . .
C70D C71D C51D 120.2(12) . .
C72D C71D C51D 116.6(11) . .
C71D C72D C73D 122.6(11) . .
C71D C72D C54D 125.2(11) . .
C73D C72D C54D 99.5(11) . .
C74D C73D C72D 113.5(12) . .
C74D C73D C82D 120.2(11) . .
C72D C73D C82D 118.9(10) . .
C75D C74D C73D 123.4(13) . .
C75D C74D C55D 116.0(10) . .
C73D C74D C55D 106.1(13) . .
C74D C75D C58D 123.8(10) . .
C74D C75D C76D 119.9(11) . .
C58D C75D C76D 113.0(13) . .
C77D C76D C81D 122.4(12) . .
C77D C76D C75D 103.1(14) . .
C81D C76D C75D 118.3(12) . .
C76D C77D C59D 112.2(13) . .
C76D C77D C78D 118.1(10) . .
C59D C77D C78D 121.5(10) . .
C79D C78D C62D 121.6(12) . .
C79D C78D C77D 113.4(11) . .
C62D C78D C77D 117.7(10) . .
C80D C79D C78D 126.2(13) . .
C80D C79D C65D 106.8(10) . .
C78D C79D C65D 117.8(11) . .
C79D C80D C67D 109.4(12) . .
C79D C80D C81D 123.6(12) . .
C67D C80D C81D 119.4(11) . .
C76D C81D C80D 115.4(11) . .
C76D C81D C82D 120.9(11) . .
C80D C81D C82D 117.7(10) . .
C69D C82D C73D 120.4(10) . .
C69D C82D C81D 116.7(10) . .
C73D C82D C81D 115.5(11) . .
S2A C1SA S1A 179.2(4) . .
S4A C2SA S3A 179.4(18) . .
S5B C3S S5B 179.999(1) . 3_655
S5B C3S S5A 44.2(3) . .
S5B C3S S5A 135.8(3) 3_655 .
S5B C3S S5A 135.8(3) . 3_655
S5B C3S S5A 44.2(3) 3_655 3_655
S5A C3S S5A 179.997(1) . 3_655
S1B C1SB S2B 172(5) . .
S4B C2SB S3B 180(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 C1A 1.494(6) .
C1 C2A 1.503(6) .
C1 C3 1.539(6) .
C1 C2 1.549(5) .
C2 C6 1.530(5) .
C2 C7 1.540(5) .
C2 H2 1.0000 .
C3 C5 1.524(7) .
C3 C4 1.531(7) .
C3 H3 1.0000 .
C4 C8 1.530(6) .
C4 H4A 0.9900 .
C4 H4B 0.9900 .
C5 C9 1.548(6) .
C5 H5A 0.9900 .
C5 H5B 0.9900 .
C6 C8 1.526(6) .
C6 H6A 0.9900 .
C6 H6B 0.9900 .
C7 C9 1.537(8) .
C7 H7A 0.9900 .
C7 H7B 0.9900 .
C8 C10 1.532(6) .
C8 H8 1.0000 .
C9 C10 1.530(6) .
C9 H9 1.0000 .
C10 H10A 0.9900 .
C10 H10B 0.9900 .
C1A C6C 1.386(8) .
C1A C10A 1.412(9) .
C1A C10B 1.417(9) .
C1A C3B 1.517(9) .
C1A C3A 1.530(9) .
C1A C7C 1.557(7) .
C2A C6A 1.377(7) .
C2A C6B 1.402(8) .
C2A C10C 1.420(9) .
C2A C3C 1.539(9) .
C2A C7B 1.549(7) .
C2A C7A 1.557(7) .
C3A C12A 1.430(11) .
C3A C4A 1.468(10) .
C4A C15A 1.455(10) .
C4A C5A 1.455(8) .
C5A C18A 1.450(10) .
C5A C6A 1.459(9) .
C6A C20A 1.440(10) .
C7A C22A 1.432(10) .
C7A C8A 1.483(9) .
C8A C24A 1.452(9) .
C8A C9A 1.460(9) .
C9A C27A 1.397(9) .
C9A C10A 1.452(10) .
C10A C11A 1.448(11) .
C11A C12A 1.418(8) .
C11A C29A 1.419(10) .
C12A C13A 1.439(11) .
C13A C14A 1.401(9) .
C13A C31A 1.421(9) .
C14A C15A 1.438(9) .
C14A C34A 1.468(8) .
C15A C16A 1.442(8) .
C16A C17A 1.393(8) .
C16A C35A 1.458(8) .
C17A C38A 1.368(9) .
C17A C18A 1.430(9) .
C18A C19A 1.430(9) .
C19A C20A 1.410(9) .
C19A C40A 1.445(9) .
C20A C21A 1.432(10) .
C21A C22A 1.402(9) .
C21A C42A 1.410(7) .
C22A C23A 1.428(9) .
C23A C44A 1.396(9) .
C23A C24A 1.448(9) .
C24A C25A 1.405(8) .
C25A C26A 1.413(8) .
C25A C46A 1.493(8) .
C26A C27A 1.425(9) .
C26A C49A 1.438(9) .
C27A C28A 1.447(9) .
C28A C29A 1.410(8) .
C28A C50A 1.425(8) .
C29A C30A 1.403(9) .
C30A C31A 1.427(8) .
C30A C52A 1.440(8) .
C31A C32A 1.442(8) .
C32A C33A 1.417(8) .
C32A C53A 1.418(9) .
C33A C34A 1.389(9) .
C33A C56A 1.502(9) .
C34A C35A 1.432(9) .
C35A C36A 1.409(8) .
C36A C37A 1.443(8) .
C36A C57A 1.491(8) .
C37A C60A 1.393(8) .
C37A C38A 1.441(8) .
C38A C39A 1.414(9) .
C39A C61A 1.402(8) .
C39A C40A 1.454(9) .
C40A C41A 1.424(9) .
C41A C42A 1.444(9) .
C41A C63A 1.450(8) .
C42A C43A 1.449(8) .
C43A C64A 1.420(8) .
C43A C44A 1.423(8) .
C44A C45A 1.442(9) .
C45A C66A 1.469(8) .
C45A C46A 1.521(10) .
C46A C47A 1.394(9) .
C47A C48A 1.424(11) .
C47A C68A 1.431(8) .
C48A C49A 1.341(8) .
C48A C70A 1.441(8) .
C49A C50A 1.434(8) .
C50A C51A 1.431(9) .
C51A C52A 1.441(9) .
C51A C71A 1.463(9) .
C52A C53A 1.444(9) .
C53A C54A 1.365(7) .
C54A C55A 1.348(9) .
C54A C72A 1.543(10) .
C55A C56A 1.462(9) .
C55A C74A 1.465(8) .
C56A C57A 1.437(9) .
C57A C58A 1.453(9) .
C58A C75A 1.415(8) .
C58A C59A 1.448(10) .
C59A C60A 1.342(8) .
C59A C77A 1.487(9) .
C60A C61A 1.478(9) .
C61A C62A 1.669(9) .
C62A C63A 1.415(9) .
C62A C78A 1.435(10) .
C63A C64A 1.436(8) .
C64A C65A 1.385(8) .
C65A C66A 1.212(9) .
C65A C79A 1.490(10) .
C66A C67A 1.426(8) .
C67A C68A 1.329(7) .
C67A C80A 1.408(8) .
C68A C69A 1.410(8) .
C69A C82A 1.399(9) .
C69A C70A 1.443(8) .
C70A C71A 1.422(9) .
C71A C72A 1.424(10) .
C72A C73A 1.443(8) .
C73A C74A 1.421(8) .
C73A C82A 1.447(8) .
C74A C75A 1.341(8) .
C75A C76A 1.447(8) .
C76A C77A 1.399(8) .
C76A C81A 1.427(9) .
C77A C78A 1.559(9) .
C78A C79A 1.405(8) .
C79A C80A 1.276(9) .
C80A C81A 1.440(8) .
C81A C82A 1.502(9) .
C3B C12B 1.427(11) .
C3B C4B 1.472(10) .
C4B C5B 1.450(8) .
C4B C15B 1.465(10) .
C5B C18B 1.449(10) .
C5B C6B 1.469(9) .
C6B C20B 1.449(10) .
C7B C22B 1.428(10) .
C7B C8B 1.487(9) .
C8B C24B 1.454(9) .
C8B C9B 1.458(9) .
C9B C27B 1.401(10) .
C9B C10B 1.448(11) .
C10B C11B 1.449(12) .
C11B C29B 1.417(11) .
C11B C12B 1.418(8) .
C12B C13B 1.443(12) .
C13B C14B 1.405(9) .
C13B C31B 1.420(9) .
C14B C15B 1.440(9) .
C14B C34B 1.464(8) .
C15B C16B 1.445(9) .
C16B C17B 1.389(9) .
C16B C35B 1.460(9) .
C17B C38B 1.371(9) .
C17B C18B 1.433(9) .
C18B C19B 1.424(9) .
C19B C20B 1.414(10) .
C19B C40B 1.445(9) .
C20B C21B 1.428(10) .
C21B C22B 1.408(10) .
C21B C42B 1.413(7) .
C22B C23B 1.424(10) .
C23B C44B 1.391(10) .
C23B C24B 1.448(9) .
C24B C25B 1.408(9) .
C25B C26B 1.417(9) .
C25B C46B 1.500(9) .
C26B C27B 1.431(9) .
C26B C49B 1.433(9) .
C27B C28B 1.454(9) .
C28B C29B 1.411(9) .
C28B C50B 1.430(9) .
C29B C30B 1.403(9) .
C30B C31B 1.429(9) .
C30B C52B 1.432(9) .
C31B C32B 1.446(9) .
C32B C53B 1.419(9) .
C32B C33B 1.420(9) .
C33B C34B 1.385(10) .
C33B C56B 1.506(9) .
C34B C35B 1.431(9) .
C35B C36B 1.410(8) .
C36B C37B 1.449(9) .
C36B C57B 1.491(9) .
C37B C60B 1.395(9) .
C37B C38B 1.441(9) .
C38B C39B 1.413(9) .
C39B C61B 1.402(9) .
C39B C40B 1.457(9) .
C40B C41B 1.421(9) .
C41B C42B 1.449(9) .
C41B C63B 1.450(9) .
C42B C43B 1.445(8) .
C43B C64B 1.419(9) .
C43B C44B 1.426(9) .
C44B C45B 1.441(9) .
C45B C66B 1.468(9) .
C45B C46B 1.520(10) .
C46B C47B 1.394(9) .
C47B C48B 1.420(11) .
C47B C68B 1.437(8) .
C48B C49B 1.340(8) .
C48B C70B 1.442(9) .
C49B C50B 1.432(9) .
C50B C51B 1.435(10) .
C51B C52B 1.438(10) .
C51B C71B 1.463(9) .
C52B C53B 1.444(9) .
C53B C54B 1.366(7) .
C54B C55B 1.348(10) .
C54B C72B 1.546(10) .
C55B C56B 1.457(10) .
C55B C74B 1.462(9) .
C56B C57B 1.438(10) .
C57B C58B 1.449(9) .
C58B C75B 1.413(8) .
C58B C59B 1.447(10) .
C59B C60B 1.342(8) .
C59B C77B 1.488(9) .
C60B C61B 1.484(9) .
C61B C62B 1.675(9) .
C62B C63B 1.419(9) .
C62B C78B 1.435(10) .
C63B C64B 1.438(9) .
C64B C65B 1.385(9) .
C65B C66B 1.207(10) .
C65B C79B 1.487(10) .
C66B C67B 1.424(9) .
C67B C68B 1.334(8) .
C67B C80B 1.411(9) .
C68B C69B 1.408(8) .
C69B C82B 1.398(9) .
C69B C70B 1.441(9) .
C70B C71B 1.421(9) .
C71B C72B 1.424(10) .
C72B C73B 1.445(9) .
C73B C74B 1.422(9) .
C73B C82B 1.448(9) .
C74B C75B 1.343(9) .
C75B C76B 1.444(9) .
C76B C77B 1.399(8) .
C76B C81B 1.428(10) .
C77B C78B 1.562(10) .
C78B C79B 1.411(8) .
C79B C80B 1.271(9) .
C80B C81B 1.436(9) .
C81B C82B 1.499(9) .
C3C C12C 1.429(11) .
C3C C4C 1.479(10) .
C4C C5C 1.448(8) .
C4C C15C 1.455(10) .
C5C C6C 1.460(9) .
C5C C18C 1.466(10) .
C6C C20C 1.438(10) .
C7C C22C 1.426(10) .
C7C C8C 1.483(9) .
C8C C9C 1.459(9) .
C8C C24C 1.459(9) .
C9C C27C 1.385(10) .
C9C C10C 1.459(11) .
C10C C11C 1.451(11) .
C11C C29C 1.419(11) .
C11C C12C 1.420(8) .
C12C C13C 1.442(11) .
C13C C14C 1.400(9) .
C13C C31C 1.415(9) .
C14C C15C 1.433(9) .
C14C C34C 1.468(8) .
C15C C16C 1.440(9) .
C16C C17C 1.390(9) .
C16C C35C 1.459(8) .
C17C C38C 1.372(9) .
C17C C18C 1.434(9) .
C18C C19C 1.431(9) .
C19C C20C 1.412(10) .
C19C C40C 1.445(9) .
C20C C21C 1.434(10) .
C21C C42C 1.406(8) .
C21C C22C 1.406(10) .
C22C C23C 1.429(9) .
C23C C44C 1.391(10) .
C23C C24C 1.451(9) .
C24C C25C 1.413(8) .
C25C C26C 1.415(9) .
C25C C46C 1.490(9) .
C26C C27C 1.422(9) .
C26C C49C 1.443(9) .
C27C C28C 1.443(9) .
C28C C29C 1.410(9) .
C28C C50C 1.427(9) .
C29C C30C 1.403(9) .
C30C C31C 1.426(9) .
C30C C52C 1.440(9) .
C31C C32C 1.441(9) .
C32C C53C 1.417(9) .
C32C C33C 1.417(9) .
C33C C34C 1.387(10) .
C33C C56C 1.500(9) .
C34C C35C 1.433(9) .
C35C C36C 1.408(8) .
C36C C37C 1.450(9) .
C36C C57C 1.494(9) .
C37C C60C 1.391(9) .
C37C C38C 1.443(9) .
C38C C39C 1.412(9) .
C39C C61C 1.410(9) .
C39C C40C 1.455(9) .
C40C C41C 1.426(9) .
C41C C42C 1.448(9) .
C41C C63C 1.451(9) .
C42C C43C 1.444(9) .
C43C C64C 1.413(9) .
C43C C44C 1.422(9) .
C44C C45C 1.441(9) .
C45C C66C 1.465(9) .
C45C C46C 1.522(10) .
C46C C47C 1.393(9) .
C47C C48C 1.422(11) .
C47C C68C 1.430(8) .
C48C C49C 1.341(8) .
C48C C70C 1.445(9) .
C49C C50C 1.436(9) .
C50C C51C 1.432(10) .
C51C C52C 1.438(10) .
C51C C71C 1.462(9) .
C52C C53C 1.444(9) .
C53C C54C 1.364(7) .
C54C C55C 1.352(10) .
C54C C72C 1.544(10) .
C55C C56C 1.457(10) .
C55C C74C 1.461(9) .
C56C C57C 1.438(10) .
C57C C58C 1.448(9) .
C58C C75C 1.412(8) .
C58C C59C 1.444(10) .
C59C C60C 1.343(8) .
C59C C77C 1.484(9) .
C60C C61C 1.477(9) .
C61C C62C 1.665(9) .
C62C C63C 1.410(9) .
C62C C78C 1.444(10) .
C63C C64C 1.436(9) .
C64C C65C 1.384(9) .
C65C C66C 1.220(10) .
C65C C79C 1.482(10) .
C66C C67C 1.427(9) .
C67C C68C 1.333(8) .
C67C C80C 1.412(9) .
C68C C69C 1.404(8) .
C69C C82C 1.399(9) .
C69C C70C 1.440(9) .
C70C C71C 1.419(9) .
C71C C72C 1.428(10) .
C72C C73C 1.448(9) .
C73C C74C 1.424(9) .
C73C C82C 1.448(9) .
C74C C75C 1.342(9) .
C75C C76C 1.443(9) .
C76C C77C 1.403(8) .
C76C C81C 1.427(10) .
C77C C78C 1.551(10) .
C78C C79C 1.410(8) .
C79C C80C 1.281(9) .
C80C C81C 1.438(9) .
C81C C82C 1.503(9) .
C11 C12 1.49(6) .
C11 C1D 1.494(8) .
C11 C2D 1.503(7) .
C11 C13 1.58(6) .
C12 C16 1.39(5) .
C12 C17 1.57(3) .
C12 H12 1.0000 .
C13 C14 1.54(3) .
C13 C15 1.55(3) .
C13 H13 1.0000 .
C14 C18 1.55(4) .
C14 H14A 0.9900 .
C14 H14B 0.9900 .
C15 C19 1.53(3) .
C15 H15A 0.9900 .
C15 H15B 0.9900 .
C16 C18 1.45(5) .
C16 H16A 0.9900 .
C16 H16B 0.9900 .
C17 C19 1.57(3) .
C17 H17A 0.9900 .
C17 H17B 0.9900 .
C18 C20 1.51(4) .
C18 H18 1.0000 .
C19 C20 1.50(4) .
C19 H19 1.0000 .
C20 H20A 0.9900 .
C20 H20B 0.9900 .
C1D C10D 1.416(9) .
C1D C3D 1.527(10) .
C2D C6D 1.388(8) .
C2D C7D 1.550(7) .
C3D C12D 1.431(11) .
C3D C4D 1.472(10) .
C4D C5D 1.448(9) .
C4D C15D 1.456(10) .
C5D C18D 1.457(10) .
C5D C6D 1.461(10) .
C6D C20D 1.443(11) .
C7D C22D 1.428(10) .
C7D C8D 1.481(9) .
C8D C24D 1.456(9) .
C8D C9D 1.457(9) .
C9D C27D 1.395(10) .
C9D C10D 1.452(11) .
C10D C11D 1.447(12) .
C11D C29D 1.419(11) .
C11D C12D 1.419(9) .
C12D C13D 1.442(12) .
C13D C14D 1.405(9) .
C13D C31D 1.419(9) .
C14D C15D 1.436(9) .
C14D C34D 1.467(9) .
C15D C16D 1.443(9) .
C16D C17D 1.390(9) .
C16D C35D 1.459(9) .
C17D C38D 1.371(10) .
C17D C18D 1.435(9) .
C18D C19D 1.430(9) .
C19D C20D 1.414(10) .
C19D C40D 1.447(9) .
C20D C21D 1.429(10) .
C21D C22D 1.406(10) .
C21D C42D 1.411(8) .
C22D C23D 1.426(10) .
C23D C44D 1.392(10) .
C23D C24D 1.449(9) .
C24D C25D 1.409(9) .
C25D C26D 1.418(9) .
C25D C46D 1.496(9) .
C26D C27D 1.429(9) .
C26D C49D 1.440(9) .
C27D C28D 1.450(9) .
C28D C29D 1.413(9) .
C28D C50D 1.430(9) .
C29D C30D 1.401(9) .
C30D C31D 1.426(9) .
C30D C52D 1.438(9) .
C31D C32D 1.444(9) .
C32D C53D 1.414(9) .
C32D C33D 1.420(9) .
C33D C34D 1.386(10) .
C33D C56D 1.504(10) .
C34D C35D 1.430(10) .
C35D C36D 1.409(8) .
C36D C37D 1.449(9) .
C36D C57D 1.490(9) .
C37D C60D 1.394(9) .
C37D C38D 1.442(9) .
C38D C39D 1.409(9) .
C39D C61D 1.406(9) .
C39D C40D 1.455(9) .
C40D C41D 1.424(9) .
C41D C42D 1.447(9) .
C41D C63D 1.452(9) .
C42D C43D 1.445(9) .
C43D C64D 1.417(9) .
C43D C44D 1.426(9) .
C44D C45D 1.438(10) .
C45D C66D 1.465(9) .
C45D C46D 1.524(10) .
C46D C47D 1.393(9) .
C47D C48D 1.422(11) .
C47D C68D 1.430(8) .
C48D C49D 1.342(9) .
C48D C70D 1.444(9) .
C49D C50D 1.434(9) .
C50D C51D 1.435(10) .
C51D C52D 1.441(10) .
C51D C71D 1.462(9) .
C52D C53D 1.447(10) .
C53D C54D 1.364(8) .
C54D C55D 1.355(10) .
C54D C72D 1.544(10) .
C55D C56D 1.455(10) .
C55D C74D 1.460(9) .
C56D C57D 1.441(10) .
C57D C58D 1.446(9) .
C58D C75D 1.409(9) .
C58D C59D 1.445(10) .
C59D C60D 1.342(8) .
C59D C77D 1.487(9) .
C60D C61D 1.480(9) .
C61D C62D 1.671(9) .
C62D C63D 1.413(9) .
C62D C78D 1.437(10) .
C63D C64D 1.437(9) .
C64D C65D 1.383(9) .
C65D C66D 1.216(10) .
C65D C79D 1.485(10) .
C66D C67D 1.426(9) .
C67D C68D 1.332(8) .
C67D C80D 1.411(9) .
C68D C69D 1.405(9) .
C69D C82D 1.398(9) .
C69D C70D 1.442(9) .
C70D C71D 1.420(9) .
C71D C72D 1.428(10) .
C72D C73D 1.445(9) .
C73D C74D 1.423(9) .
C73D C82D 1.448(9) .
C74D C75D 1.341(9) .
C75D C76D 1.445(9) .
C76D C77D 1.400(8) .
C76D C81D 1.429(10) .
C77D C78D 1.554(10) .
C78D C79D 1.409(9) .
C79D C80D 1.278(10) .
C80D C81D 1.439(9) .
C81D C82D 1.503(9) .
C1SA S2A 1.545(3) .
C1SA S1A 1.546(3) .
C2SA S4A 1.537(3) .
C2SA S3A 1.539(3) .
C3S S5B 1.493(5) .
C3S S5B 1.493(5) 3_655
C3S S5A 1.633(2) .
C3S S5A 1.633(2) 3_655
C1SB S1B 1.545(5) .
C1SB S2B 1.545(5) .
C2SB S4B 1.541(4) .
C2SB S3B 1.541(4) .
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
C1A C1 C2 C6 -67.6(4)
C2A C1 C2 C6 -169.4(3)
C3 C1 C2 C6 60.4(5)
C1A C1 C2 C7 172.0(4)
C2A C1 C2 C7 70.2(4)
C3 C1 C2 C7 -60.0(6)
C1A C1 C3 C5 -173.3(3)
C2A C1 C3 C5 -71.5(5)
C2 C1 C3 C5 59.2(5)
C1A C1 C3 C4 66.8(4)
C2A C1 C3 C4 168.6(4)
C2 C1 C3 C4 -60.7(5)
C5 C3 C4 C8 -58.0(5)
C1 C3 C4 C8 61.7(5)
C4 C3 C5 C9 59.3(5)
C1 C3 C5 C9 -59.8(5)
C7 C2 C6 C8 60.3(5)
C1 C2 C6 C8 -61.0(4)
C6 C2 C7 C9 -60.0(5)
C1 C2 C7 C9 59.8(5)
C2 C6 C8 C4 61.1(4)
C2 C6 C8 C10 -59.7(4)
C3 C4 C8 C6 -61.4(5)
C3 C4 C8 C10 58.5(4)
C2 C7 C9 C10 61.0(5)
C2 C7 C9 C5 -59.4(5)
C3 C5 C9 C10 -60.5(5)
C3 C5 C9 C7 60.4(5)
C7 C9 C10 C8 -61.1(5)
C5 C9 C10 C8 59.8(4)
C6 C8 C10 C9 59.7(4)
C4 C8 C10 C9 -59.5(4)
C2A C1 C1A C6C 84.4(10)
C3 C1 C1A C6C -158.6(9)
C2 C1 C1A C6C -33.4(11)
C2A C1 C1A C10A -86.6(7)
C3 C1 C1A C10A 30.3(8)
C2 C1 C1A C10A 155.6(6)
C2A C1 C1A C10B 83.2(9)
C3 C1 C1A C10B -159.8(9)
C2 C1 C1A C10B -34.5(10)
C2A C1 C1A C3B -89.5(7)
C3 C1 C1A C3B 27.5(8)
C2 C1 C1A C3B 152.8(7)
C2A C1 C1A C3A 81.6(6)
C3 C1 C1A C3A -161.4(6)
C2 C1 C1A C3A -36.2(7)
C2A C1 C1A C7C -73.5(5)
C3 C1 C1A C7C 43.5(6)
C2 C1 C1A C7C 168.8(5)
C1A C1 C2A C6A -83.4(7)
C3 C1 C2A C6A 159.9(6)
C2 C1 C2A C6A 32.4(7)
C1A C1 C2A C6B 77.4(8)
C3 C1 C2A C6B -39.3(9)
C2 C1 C2A C6B -166.7(8)
C1A C1 C2A C10C 91.2(10)
C3 C1 C2A C10C -25.4(12)
C2 C1 C2A C10C -152.9(9)
C1A C1 C2A C3C -78.5(8)
C3 C1 C2A C3C 164.8(8)
C2 C1 C2A C3C 37.4(8)
C1A C1 C2A C7B -78.7(8)
C3 C1 C2A C7B 164.7(8)
C2 C1 C2A C7B 37.2(8)
C1A C1 C2A C7A 77.2(5)
C3 C1 C2A C7A -39.4(7)
C2 C1 C2A C7A -166.9(5)
C6C C1A C3A C12A 6(5)
C10A C1A C3A C12A -16.3(9)
C10B C1A C3A C12A 7(10)
C1 C1A C3A C12A 172.7(7)
C3B C1A C3A C12A -14.9(12)
C7C C1A C3A C12A -35.1(11)
C6C C1A C3A C4A 152(6)
C10A C1A C3A C4A 129.5(12)
C10B C1A C3A C4A 152(12)
C1 C1A C3A C4A -41.5(13)
C3B C1A C3A C4A 130.8(10)
C7C C1A C3A C4A 110.7(11)
C12A C3A C4A C15A -10.7(15)
C1A C3A C4A C15A -152.8(9)
C12A C3A C4A C5A 134.5(11)
C1A C3A C4A C5A -7.7(16)
C15A C4A C5A C18A -3.2(15)
C3A C4A C5A C18A -147.9(9)
C15A C4A C5A C6A 145.8(9)
C3A C4A C5A C6A 1.1(16)
C6B C2A C6A C20A 26.1(14)
C10C C2A C6A C20A 11.5(10)
C1 C2A C6A C20A -172.0(8)
C3C C2A C6A C20A 156(6)
C7B C2A C6A C20A 142(10)
C7A C2A C6A C20A 27.0(11)
C6B C2A C6A C5A -122.1(10)
C10C C2A C6A C5A -136.7(12)
C1 C2A C6A C5A 39.8(13)
C3C C2A C6A C5A 8(5)
C7B C2A C6A C5A -6(9)
C7A C2A C6A C5A -121.2(10)
C18A C5A C6A C2A 160.1(9)
C4A C5A C6A C2A 8.0(17)
C18A C5A C6A C20A 8.7(12)
C4A C5A C6A C20A -143.3(11)
C6A C2A C7A C22A -26.7(11)
C6B C2A C7A C22A -7(24)
C10C C2A C7A C22A 11.7(15)
C1 C2A C7A C22A 170.2(8)
C3C C2A C7A C22A -33.9(12)
C7B C2A C7A C22A -32.4(13)
C6A C2A C7A C8A 122.4(11)
C6B C2A C7A C8A 142(26)
C10C C2A C7A C8A 161(2)
C1 C2A C7A C8A -40.7(12)
C3C C2A C7A C8A 115.2(11)
C7B C2A C7A C8A 116.7(10)
C22A C7A C8A C24A -4.6(12)
C2A C7A C8A C24A -156.0(9)
C22A C7A C8A C9A 142.6(10)
C2A C7A C8A C9A -8.8(16)
C24A C8A C9A C27A -3.0(14)
C7A C8A C9A C27A -147.0(9)
C24A C8A C9A C10A 145.9(9)
C7A C8A C9A C10A 2.0(15)
C6C C1A C10A C11A 13.9(10)
C10B C1A C10A C11A 15.2(12)
C1 C1A C10A C11A -173.0(7)
C3B C1A C10A C11A -150(8)
C3A C1A C10A C11A 17.4(9)
C7C C1A C10A C11A 155.7(19)
C6C C1A C10A C9A -135.9(12)
C10B C1A C10A C9A -134.6(10)
C1 C1A C10A C9A 37.2(13)
C3B C1A C10A C9A 60(7)
C3A C1A C10A C9A -132.4(11)
C7C C1A C10A C9A 5.9(11)
C27A C9A C10A C1A 159.2(9)
C8A C9A C10A C1A 11.1(15)
C27A C9A C10A C11A 11.0(15)
C8A C9A C10A C11A -137.1(10)
C1A C10A C11A C12A -11.8(13)
C9A C10A C11A C12A 141.9(10)
C1A C10A C11A C29A -166.2(10)
C9A C10A C11A C29A -12.5(17)
C29A C11A C12A C3A 156.1(11)
C10A C11A C12A C3A 0.7(16)
C29A C11A C12A C13A 0(2)
C10A C11A C12A C13A -155.1(11)
C4A C3A C12A C11A -141.0(11)
C1A C3A C12A C11A 9.6(14)
C4A C3A C12A C13A 13.3(19)
C1A C3A C12A C13A 163.8(11)
C11A C12A C13A C14A 146.5(12)
C3A C12A C13A C14A -5.8(19)
C11A C12A C13A C31A -4.4(19)
C3A C12A C13A C31A -156.6(11)
C31A C13A C14A C15A 147.4(9)
C12A C13A C14A C15A -3.7(16)
C31A C13A C14A C34A 8.9(15)
C12A C13A C14A C34A -142.1(9)
C13A C14A C15A C16A -145.8(10)
C34A C14A C15A C16A -2.4(12)
C13A C14A C15A C4A 5.5(16)
C34A C14A C15A C4A 148.9(10)
C5A C4A C15A C14A -143.4(10)
C3A C4A C15A C14A 2.0(16)
C5A C4A C15A C16A 4.6(15)
C3A C4A C15A C16A 150.0(9)
C14A C15A C16A C17A 147.8(9)
C4A C15A C16A C17A -4.8(16)
C14A C15A C16A C35A 1.8(12)
C4A C15A C16A C35A -150.8(9)
C15A C16A C17A C38A -148.7(9)
C35A C16A C17A C38A -6.7(14)
C15A C16A C17A C18A 3.0(15)
C35A C16A C17A C18A 145.1(8)
C38A C17A C18A C19A 5.6(15)
C16A C17A C18A C19A -145.9(9)
C38A C17A C18A C5A 149.9(9)
C16A C17A C18A C5A -1.5(15)
C4A C5A C18A C19A 149.6(10)
C6A C5A C18A C19A -5.6(12)
C4A C5A C18A C17A 1.8(15)
C6A C5A C18A C17A -153.4(9)
C17A C18A C19A C20A 149.6(10)
C5A C18A C19A C20A 0.4(13)
C17A C18A C19A C40A -0.3(16)
C5A C18A C19A C40A -149.4(10)
C18A C19A C20A C21A -146.7(10)
C40A C19A C20A C21A 4.6(16)
C18A C19A C20A C6A 5.2(13)
C40A C19A C20A C6A 156.5(10)
C2A C6A C20A C19A -162.2(9)
C5A C6A C20A C19A -8.7(13)
C2A C6A C20A C21A -11.0(16)
C5A C6A C20A C21A 142.5(10)
C19A C20A C21A C22A 140.1(10)
C6A C20A C21A C22A -7.5(15)
C19A C20A C21A C42A -7.1(15)
C6A C20A C21A C42A -154.7(9)
C42A C21A C22A C23A 8.3(14)
C20A C21A C22A C23A -139.5(9)
C42A C21A C22A C7A 154.9(9)
C20A C21A C22A C7A 7.1(15)
C8A C7A C22A C21A -145.4(9)
C2A C7A C22A C21A 9.6(16)
C8A C7A C22A C23A 4.6(13)
C2A C7A C22A C23A 159.7(8)
C21A C22A C23A C44A -5.5(16)
C7A C22A C23A C44A -156.2(10)
C21A C22A C23A C24A 147.8(9)
C7A C22A C23A C24A -2.8(13)
C44A C23A C24A C25A 1.9(15)
C22A C23A C24A C25A -151.5(9)
C44A C23A C24A C8A 153.3(10)
C22A C23A C24A C8A -0.2(12)
C9A C8A C24A C25A 0.5(15)
C7A C8A C24A C25A 151.5(10)
C9A C8A C24A C23A -148.1(9)
C7A C8A C24A C23A 2.9(12)
C23A C24A C25A C26A 152.3(8)
C8A C24A C25A C26A 6.3(15)
C23A C24A C25A C46A -2.6(14)
C8A C24A C25A C46A -148.6(9)
C24A C25A C26A C27A -10.8(14)
C46A C25A C26A C27A 144.4(9)
C24A C25A C26A C49A -150.7(8)
C46A C25A C26A C49A 4.6(13)
C10A C9A C27A C26A -150.2(9)
C8A C9A C27A C26A -1.5(16)
C10A C9A C27A C28A -2.0(15)
C8A C9A C27A C28A 146.7(9)
C25A C26A C27A C9A 9.1(16)
C49A C26A C27A C9A 152.4(10)
C25A C26A C27A C28A -142.9(9)
C49A C26A C27A C28A 0.4(12)
C9A C27A C28A C29A -7.4(15)
C26A C27A C28A C29A 145.2(9)
C9A C27A C28A C50A -152.5(9)
C26A C27A C28A C50A 0.0(12)
C50A C28A C29A C30A -2.9(14)
C27A C28A C29A C30A -143.8(9)
C50A C28A C29A C11A 147.3(9)
C27A C28A C29A C11A 6.4(14)
C12A C11A C29A C30A 4.3(18)
C10A C11A C29A C30A 154.8(10)
C12A C11A C29A C28A -146.8(12)
C10A C11A C29A C28A 3.7(17)
C28A C29A C30A C31A 144.4(9)
C11A C29A C30A C31A -4.9(14)
C28A C29A C30A C52A 3.5(14)
C11A C29A C30A C52A -145.8(9)
C14A C13A C31A C30A -147.1(9)
C12A C13A C31A C30A 3.8(16)
C14A C13A C31A C32A -6.3(16)
C12A C13A C31A C32A 144.6(10)
C29A C30A C31A C13A 0.9(15)
C52A C30A C31A C13A 145.5(9)
C29A C30A C31A C32A -144.4(8)
C52A C30A C31A C32A 0.2(12)
C13A C31A C32A C33A -3.1(14)
C30A C31A C32A C33A 142.1(9)
C13A C31A C32A C53A -148.1(9)
C30A C31A C32A C53A -2.9(11)
C53A C32A C33A C34A 150.0(8)
C31A C32A C33A C34A 9.8(13)
C53A C32A C33A C56A -3.6(13)
C31A C32A C33A C56A -143.8(8)
C32A C33A C34A C35A -148.7(8)
C56A C33A C34A C35A 3.9(14)
C32A C33A C34A C14A -7.2(13)
C56A C33A C34A C14A 145.4(8)
C13A C14A C34A C33A -2.3(14)
C15A C14A C34A C33A -144.7(9)
C13A C14A C34A C35A 144.5(9)
C15A C14A C34A C35A 2.1(11)
C33A C34A C35A C36A -3.4(13)
C14A C34A C35A C36A -149.1(8)
C33A C34A C35A C16A 144.8(9)
C14A C34A C35A C16A -0.9(10)
C17A C16A C35A C36A -1.2(13)
C15A C16A C35A C36A 146.2(9)
C17A C16A C35A C34A -148.0(9)
C15A C16A C35A C34A -0.5(11)
C34A C35A C36A C37A 153.1(8)
C16A C35A C36A C37A 9.6(12)
C34A C35A C36A C57A 1.7(12)
C16A C35A C36A C57A -141.8(8)
C35A C36A C37A C60A -150.4(7)
C57A C36A C37A C60A 1.7(12)
C35A C36A C37A C38A -10.5(12)
C57A C36A C37A C38A 141.6(7)
C16A C17A C38A C39A 148.0(8)
C18A C17A C38A C39A -3.0(13)
C16A C17A C38A C37A 5.6(14)
C18A C17A C38A C37A -145.3(9)
C60A C37A C38A C17A 147.5(8)
C36A C37A C38A C17A 3.3(13)
C60A C37A C38A C39A 1.6(10)
C36A C37A C38A C39A -142.6(8)
C17A C38A C39A C61A -148.9(8)
C37A C38A C39A C61A -1.3(10)
C17A C38A C39A C40A -5.2(14)
C37A C38A C39A C40A 142.4(9)
C20A C19A C40A C41A 2.1(15)
C18A C19A C40A C41A 148.8(9)
C20A C19A C40A C39A -153.3(9)
C18A C19A C40A C39A -6.6(15)
C61A C39A C40A C41A -2.0(14)
C38A C39A C40A C41A -144.0(9)
C61A C39A C40A C19A 151.6(8)
C38A C39A C40A C19A 9.6(14)
C19A C40A C41A C42A -6.2(14)
C39A C40A C41A C42A 145.3(8)
C19A C40A C41A C63A -146.2(8)
C39A C40A C41A C63A 5.3(14)
C22A C21A C42A C41A -144.0(8)
C20A C21A C42A C41A 2.9(13)
C22A C21A C42A C43A -2.8(13)
C20A C21A C42A C43A 144.2(9)
C40A C41A C42A C21A 3.6(13)
C63A C41A C42A C21A 148.6(8)
C40A C41A C42A C43A -142.4(8)
C63A C41A C42A C43A 2.6(10)
C21A C42A C43A C64A -148.0(8)
C41A C42A C43A C64A -2.3(10)
C21A C42A C43A C44A -5.8(13)
C41A C42A C43A C44A 139.9(8)
C22A C23A C44A C43A -3.1(15)
C24A C23A C44A C43A -152.6(9)
C22A C23A C44A C45A 145.9(9)
C24A C23A C44A C45A -3.6(15)
C64A C43A C44A C23A 146.8(8)
C42A C43A C44A C23A 8.5(13)
C64A C43A C44A C45A -5.0(12)
C42A C43A C44A C45A -143.3(7)
C23A C44A C45A C66A -148.7(9)
C43A C44A C45A C66A 1.0(12)
C23A C44A C45A C46A 5.5(13)
C43A C44A C45A C46A 155.1(7)
C24A C25A C46A C47A 152.9(9)
C26A C25A C46A C47A -0.4(14)
C24A C25A C46A C45A 4.8(14)
C26A C25A C46A C45A -148.5(8)
C44A C45A C46A C47A -154.8(8)
C66A C45A C46A C47A 0.1(12)
C44A C45A C46A C25A -5.9(12)
C66A C45A C46A C25A 149.0(8)
C25A C46A C47A C48A -1.3(13)
C45A C46A C47A C48A 148.0(8)
C25A C46A C47A C68A -145.8(8)
C45A C46A C47A C68A 3.5(13)
C46A C47A C48A C49A -1.3(13)
C68A C47A C48A C49A 148.5(8)
C46A C47A C48A C70A -142.4(8)
C68A C47A C48A C70A 7.4(10)
C47A C48A C49A C50A -140.9(8)
C70A C48A C49A C50A -2.9(12)
C47A C48A C49A C26A 5.8(13)
C70A C48A C49A C26A 143.8(8)
C25A C26A C49A C48A -7.3(13)
C27A C26A C49A C48A -152.3(9)
C25A C26A C49A C50A 144.3(8)
C27A C26A C49A C50A -0.7(11)
C29A C28A C50A C51A -0.6(13)
C27A C28A C50A C51A 145.0(8)
C29A C28A C50A C49A -146.1(8)
C27A C28A C50A C49A -0.4(11)
C48A C49A C50A C28A 151.1(8)
C26A C49A C50A C28A 0.7(10)
C48A C49A C50A C51A 5.7(13)
C26A C49A C50A C51A -144.7(8)
C28A C50A C51A C52A 3.4(13)
C49A C50A C51A C52A 144.6(8)
C28A C50A C51A C71A -145.2(8)
C49A C50A C51A C71A -4.0(12)
C29A C30A C52A C51A -0.6(13)
C31A C30A C52A C51A -145.9(9)
C29A C30A C52A C53A 147.7(9)
C31A C30A C52A C53A 2.4(11)
C50A C51A C52A C30A -2.8(13)
C71A C51A C52A C30A 144.8(8)
C50A C51A C52A C53A -145.4(8)
C71A C51A C52A C53A 2.1(13)
C33A C32A C53A C54A 6.5(13)
C31A C32A C53A C54A 151.2(8)
C33A C32A C53A C52A -140.2(9)
C31A C32A C53A C52A 4.5(10)
C30A C52A C53A C54A -149.9(8)
C51A C52A C53A C54A -3.0(13)
C30A C52A C53A C32A -4.3(10)
C51A C52A C53A C32A 142.7(9)
C32A C53A C54A C55A -5.0(13)
C52A C53A C54A C55A 137.4(9)
C32A C53A C54A C72A -143.3(7)
C52A C53A C54A C72A -1.0(11)
C53A C54A C55A C56A 0.6(13)
C72A C54A C55A C56A 140.5(8)
C53A C54A C55A C74A -147.3(8)
C72A C54A C55A C74A -7.4(10)
C54A C55A C56A C57A -149.8(7)
C74A C55A C56A C57A -7.1(13)
C54A C55A C56A C33A 2.4(13)
C74A C55A C56A C33A 145.1(8)
C34A C33A C56A C57A -2.5(13)
C32A C33A C56A C57A 150.8(8)
C34A C33A C56A C55A -154.1(8)
C32A C33A C56A C55A -0.8(12)
C55A C56A C57A C58A -0.8(12)
C33A C56A C57A C58A -153.8(7)
C55A C56A C57A C36A 153.8(7)
C33A C56A C57A C36A 0.9(12)
C35A C36A C57A C56A -0.5(12)
C37A C36A C57A C56A -151.0(8)
C35A C36A C57A C58A 154.5(7)
C37A C36A C57A C58A 4.0(11)
C56A C57A C58A C75A 7.2(12)
C36A C57A C58A C75A -148.1(7)
C56A C57A C58A C59A 148.1(8)
C36A C57A C58A C59A -7.1(11)
C75A C58A C59A C60A 150.3(7)
C57A C58A C59A C60A 4.7(11)
C75A C58A C59A C77A 4.8(9)
C57A C58A C59A C77A -140.8(7)
C58A C59A C60A C37A 1.4(12)
C77A C59A C60A C37A 141.3(8)
C58A C59A C60A C61A -141.8(7)
C77A C59A C60A C61A -1.9(11)
C38A C37A C60A C59A -148.5(8)
C36A C37A C60A C59A -4.6(12)
C38A C37A C60A C61A -1.2(10)
C36A C37A C60A C61A 142.7(8)
C38A C39A C61A C60A 0.5(10)
C40A C39A C61A C60A -147.9(8)
C38A C39A C61A C62A 145.3(8)
C40A C39A C61A C62A -3.2(12)
C59A C60A C61A C39A 148.7(8)
C37A C60A C61A C39A 0.4(10)
C59A C60A C61A C62A 2.7(11)
C37A C60A C61A C62A -145.5(7)
C39A C61A C62A C63A 5.2(12)
C60A C61A C62A C63A 145.7(8)
C39A C61A C62A C78A -139.8(8)
C60A C61A C62A C78A 0.6(12)
C78A C62A C63A C64A 2.9(13)
C61A C62A C63A C64A -142.1(8)
C78A C62A C63A C41A 143.1(8)
C61A C62A C63A C41A -2.0(12)
C40A C41A C63A C62A -2.8(13)
C42A C41A C63A C62A -146.9(8)
C40A C41A C63A C64A 142.2(9)
C42A C41A C63A C64A -1.9(10)
C44A C43A C64A C65A 5.1(13)
C42A C43A C64A C65A 147.9(8)
C44A C43A C64A C63A -141.7(8)
C42A C43A C64A C63A 1.1(11)
C62A C63A C64A C65A -3.0(14)
C41A C63A C64A C65A -147.5(8)
C62A C63A C64A C43A 145.0(8)
C41A C63A C64A C43A 0.5(11)
C43A C64A C65A C66A -0.1(15)
C63A C64A C65A C66A 143.2(9)
C43A C64A C65A C79A -142.7(8)
C63A C64A C65A C79A 0.7(14)
C64A C65A C66A C67A -152.8(8)
C79A C65A C66A C67A -5.7(12)
C64A C65A C66A C45A -4.3(14)
C79A C65A C66A C45A 142.7(8)
C44A C45A C66A C65A 4.0(14)
C46A C45A C66A C65A -149.4(9)
C44A C45A C66A C67A 150.1(8)
C46A C45A C66A C67A -3.3(12)
C65A C66A C67A C68A 152.7(8)
C45A C66A C67A C68A 3.1(12)
C65A C66A C67A C80A 7.3(11)
C45A C66A C67A C80A -142.2(8)
C80A C67A C68A C69A -0.6(11)
C66A C67A C68A C69A -139.7(8)
C80A C67A C68A C47A 139.4(7)
C66A C67A C68A C47A 0.4(12)
C46A C47A C68A C67A -4.0(13)
C48A C47A C68A C67A -152.2(7)
C46A C47A C68A C69A 140.3(8)
C48A C47A C68A C69A -7.9(9)
C67A C68A C69A C82A 0.8(11)
C47A C68A C69A C82A -143.3(8)
C67A C68A C69A C70A 149.5(7)
C47A C68A C69A C70A 5.4(9)
C49A C48A C70A C71A -1.3(12)
C47A C48A C70A C71A 142.3(8)
C49A C48A C70A C69A -147.7(7)
C47A C48A C70A C69A -4.1(9)
C82A C69A C70A C71A 2.1(12)
C68A C69A C70A C71A -147.1(8)
C82A C69A C70A C48A 148.4(7)
C68A C69A C70A C48A -0.8(9)
C48A C70A C71A C72A -147.3(8)
C69A C70A C71A C72A -5.9(13)
C48A C70A C71A C51A 2.7(13)
C69A C70A C71A C51A 144.0(8)
C50A C51A C71A C70A 0.0(13)
C52A C51A C71A C70A -148.4(8)
C50A C51A C71A C72A 151.0(8)
C52A C51A C71A C72A 2.6(12)
C70A C71A C72A C73A 4.3(13)
C51A C71A C72A C73A -147.4(8)
C70A C71A C72A C54A 144.7(8)
C51A C71A C72A C54A -7.0(13)
C55A C54A C72A C71A -139.3(10)
C53A C54A C72A C71A 6.3(13)
C55A C54A C72A C73A 5.7(9)
C53A C54A C72A C73A 151.3(7)
C71A C72A C73A C74A 146.8(9)
C54A C72A C73A C74A -1.6(10)
C71A C72A C73A C82A 1.1(13)
C54A C72A C73A C82A -147.4(7)
C72A C73A C74A C75A -145.3(8)
C82A C73A C74A C75A 2.2(13)
C72A C73A C74A C55A -2.6(11)
C82A C73A C74A C55A 144.9(7)
C54A C55A C74A C75A 153.3(8)
C56A C55A C74A C75A 8.5(13)
C54A C55A C74A C73A 6.4(11)
C56A C55A C74A C73A -138.4(9)
C73A C74A C75A C58A 138.3(8)
C55A C74A C75A C58A -1.7(12)
C73A C74A C75A C76A -3.8(13)
C55A C74A C75A C76A -143.8(7)
C59A C58A C75A C74A -151.0(8)
C57A C58A C75A C74A -6.0(12)
C59A C58A C75A C76A -5.7(9)
C57A C58A C75A C76A 139.3(7)
C74A C75A C76A C77A 151.6(8)
C58A C75A C76A C77A 4.4(9)
C74A C75A C76A C81A 3.5(11)
C58A C75A C76A C81A -143.7(8)
C81A C76A C77A C59A 146.3(8)
C75A C76A C77A C59A -1.4(9)
C81A C76A C77A C78A -0.1(12)
C75A C76A C77A C78A -147.7(7)
C60A C59A C77A C76A -146.7(7)
C58A C59A C77A C76A -2.1(9)
C60A C59A C77A C78A -2.2(12)
C58A C59A C77A C78A 142.5(8)
C63A C62A C78A C79A -0.4(15)
C61A C62A C78A C79A 143.8(9)
C63A C62A C78A C77A -148.4(8)
C61A C62A C78A C77A -4.2(12)
C76A C77A C78A C79A -5.3(12)
C59A C77A C78A C79A -146.2(8)
C76A C77A C78A C62A 146.3(8)
C59A C77A C78A C62A 5.3(12)
C62A C78A C79A C80A -141.0(9)
C77A C78A C79A C80A 8.0(15)
C62A C78A C79A C65A -1.8(15)
C77A C78A C79A C65A 147.2(8)
C66A C65A C79A C80A 1.9(12)
C64A C65A C79A C80A 148.6(9)
C66A C65A C79A C78A -145.0(9)
C64A C65A C79A C78A 1.6(15)
C78A C79A C80A C67A 144.8(9)
C65A C79A C80A C67A 2.8(10)
C78A C79A C80A C81A -4.8(15)
C65A C79A C80A C81A -146.8(8)
C68A C67A C80A C79A -151.3(8)
C66A C67A C80A C79A -5.9(10)
C68A C67A C80A C81A -0.6(11)
C66A C67A C80A C81A 144.8(8)
C77A C76A C81A C80A 3.7(12)
C75A C76A C81A C80A 147.6(7)
C77A C76A C81A C82A -145.7(7)
C75A C76A C81A C82A -1.8(11)
C79A C80A C81A C76A -1.6(12)
C67A C80A C81A C76A -148.3(7)
C79A C80A C81A C82A 148.3(8)
C67A C80A C81A C82A 1.6(11)
C68A C69A C82A C73A 148.1(7)
C70A C69A C82A C73A 3.3(11)
C68A C69A C82A C81A 0.3(11)
C70A C69A C82A C81A -144.5(7)
C74A C73A C82A C69A -147.9(7)
C72A C73A C82A C69A -4.9(12)
C74A C73A C82A C81A -0.3(11)
C72A C73A C82A C81A 142.8(8)
C76A C81A C82A C69A 147.6(7)
C80A C81A C82A C69A -1.4(11)
C76A C81A C82A C73A 0.2(11)
C80A C81A C82A C73A -148.9(7)
C6C C1A C3B C12B 10.5(13)
C10A C1A C3B C12B 27(7)
C10B C1A C3B C12B 11.8(12)
C1 C1A C3B C12B -174.3(8)
C3A C1A C3B C12B 13.8(13)
C7C C1A C3B C12B 140(2)
C6C C1A C3B C4B -124.4(12)
C10A C1A C3B C4B -108(8)
C10B C1A C3B C4B -123.2(12)
C1 C1A C3B C4B 50.8(14)
C3A C1A C3B C4B -121.1(10)
C7C C1A C3B C4B 5.4(14)
C12B C3B C4B C5B -133.8(14)
C1A C3B C4B C5B -4(2)
C12B C3B C4B C15B 24.8(18)
C1A C3B C4B C15B 154.3(10)
C15B C4B C5B C18B -6(2)
C3B C4B C5B C18B 152.3(13)
C15B C4B C5B C6B -148.0(13)
C3B C4B C5B C6B 10(2)
C6A C2A C6B C20B -24.5(17)
C10C C2A C6B C20B 15.2(19)
C1 C2A C6B C20B 172.0(11)
C3C C2A C6B C20B -31.5(17)
C7B C2A C6B C20B -30.1(16)
C7A C2A C6B C20B 175(100)
C6A C2A C6B C5B 127.1(16)
C10C C2A C6B C5B 167(4)
C1 C2A C6B C5B -36(2)
C3C C2A C6B C5B 120.1(17)
C7B C2A C6B C5B 121.6(18)
C7A C2A C6B C5B -33(24)
C18B C5B C6B C2A -158.5(16)
C4B C5B C6B C2A -13(2)
C18B C5B C6B C20B -3.7(16)
C4B C5B C6B C20B 141.4(13)
C6A C2A C7B C22B -33(9)
C6B C2A C7B C22B 33.7(16)
C10C C2A C7B C22B 17.3(16)
C1 C2A C7B C22B -169.3(11)
C3C C2A C7B C22B -171(21)
C7A C2A C7B C22B 34.8(17)
C6A C2A C7B C8B 170(11)
C6B C2A C7B C8B -123.6(15)
C10C C2A C7B C8B -140.0(14)
C1 C2A C7B C8B 33.4(18)
C3C C2A C7B C8B 32(19)
C7A C2A C7B C8B -122.5(13)
C22B C7B C8B C24B 1.2(18)
C2A C7B C8B C24B 158.8(13)
C22B C7B C8B C9B -137.6(14)
C2A C7B C8B C9B 20(2)
C24B C8B C9B C27B 16(2)
C7B C8B C9B C27B 146.2(13)
C24B C8B C9B C10B -142.0(14)
C7B C8B C9B C10B -12(2)
C6C C1A C10B C9B 152(21)
C10A C1A C10B C9B 131.1(15)
C1 C1A C10B C9B -41(2)
C3B C1A C10B C9B 132.6(17)
C3A C1A C10B C9B -26(10)
C7C C1A C10B C9B 113.9(16)
C6C C1A C10B C11B 8(19)
C10A C1A C10B C11B -13.5(16)
C1 C1A C10B C11B 174.1(11)
C3B C1A C10B C11B -11.9(15)
C3A C1A C10B C11B -171(12)
C7C C1A C10B C11B -30.7(17)
C27B C9B C10B C1A -158.1(15)
C8B C9B C10B C1A -2(3)
C27B C9B C10B C11B -14(2)
C8B C9B C10B C11B 141.7(16)
C1A C10B C11B C29B 167.1(15)
C9B C10B C11B C29B 16(3)
C1A C10B C11B C12B 8(2)
C9B C10B C11B C12B -143.2(15)
C29B C11B C12B C3B -161.1(14)
C10B C11B C12B C3B 0(2)
C29B C11B C12B C13B -8(3)
C10B C11B C12B C13B 154.0(14)
C4B C3B C12B C11B 128.5(14)
C1A C3B C12B C11B -7.5(18)
C4B C3B C12B C13B -24(2)
C1A C3B C12B C13B -160.2(12)
C11B C12B C13B C14B -142.8(16)
C3B C12B C13B C14B 8(2)
C11B C12B C13B C31B 9(2)
C3B C12B C13B C31B 159.7(13)
C31B C13B C14B C15B -145.9(12)
C12B C13B C14B C15B 6(2)
C31B C13B C14B C34B -7.4(19)
C12B C13B C14B C34B 144.7(12)
C13B C14B C15B C16B 147.2(12)
C34B C14B C15B C16B 4.2(16)
C13B C14B C15B C4B -3(2)
C34B C14B C15B C4B -146.3(13)
C5B C4B C15B C14B 149.0(13)
C3B C4B C15B C14B -12(2)
C5B C4B C15B C16B 3(2)
C3B C4B C15B C16B -158.6(12)
C14B C15B C16B C17B -149.8(12)
C4B C15B C16B C17B 2(2)
C14B C15B C16B C35B -3.0(16)
C4B C15B C16B C35B 149.1(13)
C15B C16B C17B C38B 146.0(13)
C35B C16B C17B C38B 2.2(18)
C15B C16B C17B C18B -4(2)
C35B C16B C17B C18B -147.7(11)
C38B C17B C18B C19B -6(2)
C16B C17B C18B C19B 144.5(12)
C38B C17B C18B C5B -150.0(13)
C16B C17B C18B C5B 0(2)
C4B C5B C18B C19B -144.4(12)
C6B C5B C18B C19B -0.1(16)
C4B C5B C18B C17B 4(2)
C6B C5B C18B C17B 148.8(13)
C17B C18B C19B C20B -145.1(13)
C5B C18B C19B C20B 4.0(16)
C17B C18B C19B C40B 5(2)
C5B C18B C19B C40B 154.3(12)
C18B C19B C20B C21B 150.8(12)
C40B C19B C20B C21B 1(2)
C18B C19B C20B C6B -6.9(18)
C40B C19B C20B C6B -156.4(13)
C2A C6B C20B C19B 167.2(12)
C5B C6B C20B C19B 6.4(17)
C2A C6B C20B C21B 11(2)
C5B C6B C20B C21B -149.5(14)
C19B C20B C21B C22B -149.5(13)
C6B C20B C21B C22B 6(2)
C19B C20B C21B C42B 2(2)
C6B C20B C21B C42B 157.0(13)
C42B C21B C22B C23B -14(2)
C20B C21B C22B C23B 138.8(14)
C42B C21B C22B C7B -153.8(14)
C20B C21B C22B C7B -1(2)
C8B C7B C22B C21B 141.9(13)
C2A C7B C22B C21B -19(2)
C8B C7B C22B C23B -3(2)
C2A C7B C22B C23B -163.2(12)
C21B C22B C23B C44B 7(3)
C7B C22B C23B C44B 153.8(14)
C21B C22B C23B C24B -143.2(13)
C7B C22B C23B C24B 3.1(19)
C44B C23B C24B C25B -4(2)
C22B C23B C24B C25B 147.3(14)
C44B C23B C24B C8B -154.4(13)
C22B C23B C24B C8B -2.6(19)
C9B C8B C24B C25B -11(2)
C7B C8B C24B C25B -149.0(13)
C9B C8B C24B C23B 138.8(12)
C7B C8B C24B C23B 0.9(17)
C23B C24B C25B C26B -151.8(13)
C8B C24B C25B C26B -5(2)
C23B C24B C25B C46B 4(2)
C8B C24B C25B C46B 151.0(12)
C24B C25B C26B C27B 13(2)
C46B C25B C26B C27B -142.9(12)
C24B C25B C26B C49B 151.9(12)
C46B C25B C26B C49B -3.6(19)
C10B C9B C27B C26B 150.9(14)
C8B C9B C27B C26B -8(3)
C10B C9B C27B C28B 7(3)
C8B C9B C27B C28B -152.0(12)
C25B C26B C27B C9B -6(3)
C49B C26B C27B C9B -148.7(15)
C25B C26B C27B C28B 141.5(12)
C49B C26B C27B C28B -1.0(16)
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C26B C27B C28B C29B -150.3(13)
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C26B C27B C28B C50B 0.9(17)
C50B C28B C29B C30B -2(2)
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C50B C28B C29B C11B -148.9(13)
C27B C28B C29B C11B -1(2)
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C10B C11B C29B C28B -9(3)
C28B C29B C30B C31B -139.2(13)
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C28B C29B C30B C52B -1(2)
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C14B C13B C31B C30B 148.3(12)
C12B C13B C31B C30B -4(2)
C14B C13B C31B C32B 3(2)
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C29B C30B C31B C13B -3(2)
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C29B C30B C31B C32B 145.3(11)
C52B C30B C31B C32B 2.7(16)
C13B C31B C32B C53B 148.3(12)
C30B C31B C32B C53B -0.4(15)
C13B C31B C32B C33B 6.4(19)
C30B C31B C32B C33B -142.3(12)
C53B C32B C33B C34B -146.9(11)
C31B C32B C33B C34B -11.4(18)
C53B C32B C33B C56B 5.6(18)
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C32B C33B C34B C35B 149.6(11)
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C32B C33B C34B C14B 7.1(18)
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C33B C34B C35B C16B -144.7(11)
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C17B C16B C35B C36B 3.1(18)
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C34B C35B C36B C57B -0.9(16)
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C35B C36B C37B C60B 148.0(10)
C57B C36B C37B C60B -4.7(16)
C35B C36B C37B C38B 15.7(16)
C57B C36B C37B C38B -137.0(11)
C16B C17B C38B C39B -153.7(11)
C18B C17B C38B C39B -3.7(19)
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C60B C37B C38B C17B -149.6(12)
C36B C37B C38B C17B -11.9(19)
C60B C37B C38B C39B 8.4(14)
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C17B C38B C39B C61B 150.2(12)
C37B C38B C39B C61B -8.1(14)
C17B C38B C39B C40B 15.0(19)
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C20B C19B C40B C41B -1(2)
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C20B C19B C40B C39B 150.0(12)
C18B C19B C40B C39B 4.8(18)
C61B C39B C40B C41B 2.6(17)
C38B C39B C40B C41B 133.5(12)
C61B C39B C40B C19B -145.6(11)
C38B C39B C40B C19B -14.7(17)
C19B C40B C41B C42B -1.7(18)
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C19B C40B C41B C63B 148.4(11)
C39B C40B C41B C63B 1(2)
C22B C21B C42B C43B 11.0(19)
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C22B C21B C42B C41B 146.2(12)
C20B C21B C42B C41B -4.7(18)
C40B C41B C42B C21B 4.6(18)
C63B C41B C42B C21B -149.0(10)
C40B C41B C42B C43B 145.3(12)
C63B C41B C42B C43B -8.4(13)
C21B C42B C43B C64B 147.0(11)
C41B C42B C43B C64B 8.0(13)
C21B C42B C43B C44B -0.8(19)
C41B C42B C43B C44B -139.8(11)
C22B C23B C44B C43B 3(2)
C24B C23B C44B C43B 150.6(12)
C22B C23B C44B C45B -141.4(14)
C24B C23B C44B C45B 6(2)
C64B C43B C44B C23B -148.7(12)
C42B C43B C44B C23B -6.3(19)
C64B C43B C44B C45B 1.1(17)
C42B C43B C44B C45B 143.5(11)
C23B C44B C45B C66B 151.5(12)
C43B C44B C45B C66B 5.4(17)
C23B C44B C45B C46B -6.4(18)
C43B C44B C45B C46B -152.6(10)
C24B C25B C46B C47B -157.9(12)
C26B C25B C46B C47B -2.5(18)
C24B C25B C46B C45B -4.6(19)
C26B C25B C46B C45B 150.8(11)
C44B C45B C46B C47B 159.7(10)
C66B C45B C46B C47B 0.3(16)
C44B C45B C46B C25B 5.5(16)
C66B C45B C46B C25B -153.9(10)
C25B C46B C47B C48B 6.7(17)
C45B C46B C47B C48B -148.4(10)
C25B C46B C47B C68B 145.2(11)
C45B C46B C47B C68B -9.8(17)
C46B C47B C48B C49B -5.0(18)
C68B C47B C48B C49B -150.5(11)
C46B C47B C48B C70B 141.8(10)
C68B C47B C48B C70B -3.7(13)
C47B C48B C49B C50B 138.9(11)
C70B C48B C49B C50B -5.8(17)
C47B C48B C49B C26B -1.3(19)
C70B C48B C49B C26B -146.0(11)
C25B C26B C49B C48B 5.5(19)
C27B C26B C49B C48B 147.1(12)
C25B C26B C49B C50B -140.8(12)
C27B C26B C49B C50B 0.8(15)
C29B C28B C50B C49B 152.4(11)
C27B C28B C50B C49B -0.5(16)
C29B C28B C50B C51B 4.6(19)
C27B C28B C50B C51B -148.3(12)
C48B C49B C50B C28B -145.0(11)
C26B C49B C50B C28B -0.2(14)
C48B C49B C50B C51B 2.5(19)
C26B C49B C50B C51B 147.3(11)
C28B C50B C51B C52B -3.8(18)
C49B C50B C51B C52B -147.6(11)
C28B C50B C51B C71B 142.6(11)
C49B C50B C51B C71B -1.1(17)
C29B C30B C52B C51B 2(2)
C31B C30B C52B C51B 144.7(12)
C29B C30B C52B C53B -147.0(11)
C31B C30B C52B C53B -3.8(15)
C50B C51B C52B C30B 0.8(18)
C71B C51B C52B C30B -144.3(11)
C50B C51B C52B C53B 143.4(12)
C71B C51B C52B C53B -1.7(19)
C33B C32B C53B C54B -9.4(18)
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C31B C32B C53B C52B -2.0(13)
C30B C52B C53B C54B 150.9(11)
C51B C52B C53B C54B 3.7(19)
C30B C52B C53B C32B 3.6(14)
C51B C52B C53B C32B -143.5(12)
C32B C53B C54B C55B 7.0(19)
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C32B C53B C54B C72B 145.5(11)
C52B C53B C54B C72B 0.4(16)
C53B C54B C55B C56B -1(2)
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C53B C54B C55B C74B 145.3(11)
C72B C54B C55B C74B 5.1(14)
C54B C55B C56B C57B 151.1(11)
C74B C55B C56B C57B 9.4(19)
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C34B C33B C56B C57B -1.1(18)
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C32B C33B C56B C55B 0.6(18)
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C33B C56B C57B C36B 2.7(16)
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C35B C36B C57B C58B -153.3(10)
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C56B C57B C58B C75B -6.0(17)
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C56B C57B C58B C59B -145.2(11)
C36B C57B C58B C59B 6.9(15)
C75B C58B C59B C60B -149.3(11)
C57B C58B C59B C60B -4.4(17)
C75B C58B C59B C77B -4.1(13)
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C58B C59B C60B C37B -3.3(18)
C77B C59B C60B C37B -144.1(11)
C58B C59B C60B C61B 143.8(11)
C77B C59B C60B C61B 3.0(17)
C38B C37B C60B C59B 146.1(11)
C36B C37B C60B C59B 7.9(17)
C38B C37B C60B C61B -5.0(12)
C36B C37B C60B C61B -143.2(10)
C38B C39B C61B C60B 4.7(13)
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C38B C39B C61B C62B -140.4(10)
C40B C39B C61B C62B -0.9(16)
C59B C60B C61B C39B -151.9(10)
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C39B C61B C62B C63B -4.2(17)
C60B C61B C62B C63B -146.3(10)
C39B C61B C62B C78B 142.4(11)
C60B C61B C62B C78B 0.3(17)
C78B C62B C63B C64B -4.0(18)
C61B C62B C63B C64B 143.2(11)
C78B C62B C63B C41B -139.6(11)
C61B C62B C63B C41B 7.6(17)
C40B C41B C63B C62B -6.6(19)
C42B C41B C63B C62B 147.3(11)
C40B C41B C63B C64B -148.5(12)
C42B C41B C63B C64B 5.4(14)
C44B C43B C64B C65B -1.3(19)
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C44B C43B C64B C63B 142.2(12)
C42B C43B C64B C63B -4.7(15)
C62B C63B C64B C65B 2.0(19)
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C62B C63B C64B C43B -141.2(11)
C41B C63B C64B C43B -0.4(15)
C43B C64B C65B C66B -6.3(19)
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C43B C64B C65B C79B 141.1(11)
C63B C64B C65B C79B 0.6(18)
C64B C65B C66B C67B 151.3(11)
C79B C65B C66B C67B -0.2(13)
C64B C65B C66B C45B 12.4(18)
C79B C65B C66B C45B -139.1(10)
C44B C45B C66B C65B -12.4(18)
C46B C45B C66B C65B 144.4(11)
C44B C45B C66B C67B -147.6(11)
C46B C45B C66B C67B 9.2(16)
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C45B C66B C67B C68B -10.4(17)
C65B C66B C67B C80B 1.1(14)
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C80B C67B C68B C47B -145.2(11)
C66B C67B C68B C47B 1.4(17)
C46B C47B C68B C67B 9.5(18)
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C46B C47B C68B C69B -139.1(11)
C48B C47B C68B C69B 4.1(12)
C67B C68B C69B C82B -3.7(17)
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C67B C68B C69B C70B -150.5(10)
C47B C68B C69B C70B -2.9(13)
C82B C69B C70B C71B -2.8(17)
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C82B C69B C70B C48B -145.8(10)
C68B C69B C70B C48B 0.6(12)
C49B C48B C70B C71B 8.0(17)
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C49B C48B C70B C69B 151.2(10)
C47B C48B C70B C69B 2.0(13)
C69B C70B C71B C72B 8.3(17)
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C69B C70B C71B C51B -144.7(11)
C48B C70B C71B C51B -7.1(17)
C50B C51B C71B C70B 3.5(17)
C52B C51B C71B C70B 149.7(11)
C50B C51B C71B C72B -150.6(10)
C52B C51B C71B C72B -4.4(17)
C70B C71B C72B C73B -7.1(18)
C51B C71B C72B C73B 147.7(11)
C70B C71B C72B C54B -145.6(11)
C51B C71B C72B C54B 9.2(18)
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C53B C54B C72B C71B -7.3(17)
C55B C54B C72B C73B -4.1(13)
C53B C54B C72B C73B -150.5(10)
C71B C72B C73B C74B -145.5(12)
C54B C72B C73B C74B 1.6(15)
C71B C72B C73B C82B 1(2)
C54B C72B C73B C82B 147.6(12)
C72B C73B C74B C75B 146.7(12)
C82B C73B C74B C75B -2(2)
C72B C73B C74B C55B 1.3(17)
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C54B C55B C74B C75B -153.1(11)
C56B C55B C74B C75B -10(2)
C54B C55B C74B C73B -4.2(17)
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C73B C74B C75B C58B -140.1(13)
C55B C74B C75B C58B 2(2)
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C55B C74B C75B C76B 144.4(12)
C59B C58B C75B C74B 150.6(12)
C57B C58B C75B C74B 6(2)
C59B C58B C75B C76B 5.8(15)
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C60B C59B C77B C76B 145.2(11)
C58B C59B C77B C76B 0.9(13)
C60B C59B C77B C78B 4.9(18)
C58B C59B C77B C78B -139.3(11)
C63B C62B C78B C79B 4(2)
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C61B C62B C78B C77B 6.5(16)
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C59B C77B C78B C62B -9.6(17)
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C77B C76B C81B C80B 1(2)
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C75B C76B C81B C82B -5.0(19)
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C6A C2A C3C C12C -22(5)
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C10C C2A C3C C12C 14.1(14)
C1 C2A C3C C12C -172.6(10)
C7B C2A C3C C12C 6(19)
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C6A C2A C3C C4C -167(7)
C6B C2A C3C C4C -114.8(15)
C10C C2A C3C C4C -131.8(16)
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C7B C2A C3C C4C -140(21)
C7A C2A C3C C4C -113.6(14)
C12C C3C C4C C5C -140.7(15)
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C12C C3C C4C C15C 6(2)
C2A C3C C4C C15C 152.5(12)
C15C C4C C5C C6C -148.2(15)
C3C C4C C5C C6C 2(3)
C15C C4C C5C C18C -4(2)
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C10A C1A C6C C20C -15.6(15)
C10B C1A C6C C20C -174(21)
C1 C1A C6C C20C 171.1(11)
C3B C1A C6C C20C -13.9(17)
C3A C1A C6C C20C -174(6)
C7C C1A C6C C20C -31.8(17)
C10A C1A C6C C5C 134.8(15)
C10B C1A C6C C5C -24(18)
C1 C1A C6C C5C -38(2)
C3B C1A C6C C5C 136.5(14)
C3A C1A C6C C5C -23(4)
C7C C1A C6C C5C 118.6(13)
C4C C5C C6C C1A -12(3)
C18C C5C C6C C1A -162.2(13)
C4C C5C C6C C20C 139.3(17)
C18C C5C C6C C20C -10.8(18)
C6C C1A C7C C22C 26.5(12)
C10A C1A C7C C22C -16.2(12)
C10B C1A C7C C22C 29.1(12)
C1 C1A C7C C22C -171.9(8)
C3B C1A C7C C22C -29.5(16)
C3A C1A C7C C22C 33.2(11)
C6C C1A C7C C8C -116.9(12)
C10A C1A C7C C8C -160(2)
C10B C1A C7C C8C -114.4(12)
C1 C1A C7C C8C 44.6(12)
C3B C1A C7C C8C -173(3)
C3A C1A C7C C8C -110.3(11)
C22C C7C C8C C9C -147.5(13)
C1A C7C C8C C9C -1(2)
C22C C7C C8C C24C 9.0(13)
C1A C7C C8C C24C 155.6(9)
C24C C8C C9C C27C -9.3(16)
C7C C8C C9C C27C 146.1(12)
C24C C8C C9C C10C -146.2(10)
C7C C8C C9C C10C 9.1(18)
C6A C2A C10C C11C -12.3(11)
C6B C2A C10C C11C -156(3)
C1 C2A C10C C11C 172.0(7)
C3C C2A C10C C11C -17.0(12)
C7B C2A C10C C11C -16.6(14)
C7A C2A C10C C11C -158(2)
C6A C2A C10C C9C 142.9(13)
C6B C2A C10C C9C -0.7(18)
C1 C2A C10C C9C -32.9(19)
C3C C2A C10C C9C 138.1(13)
C7B C2A C10C C9C 138.6(12)
C7A C2A C10C C9C -2.5(11)
C27C C9C C10C C2A -159.9(11)
C8C C9C C10C C2A -20.8(16)
C27C C9C C10C C11C -6.6(18)
C8C C9C C10C C11C 132.4(12)
C2A C10C C11C C29C 167.2(9)
C9C C10C C11C C29C 11(2)
C2A C10C C11C C12C 15.0(16)
C9C C10C C11C C12C -141.3(12)
C29C C11C C12C C3C -156.5(12)
C10C C11C C12C C3C -4.9(17)
C29C C11C C12C C13C 6(2)
C10C C11C C12C C13C 157.5(12)
C4C C3C C12C C11C 148.1(12)
C2A C3C C12C C11C -5.8(17)
C4C C3C C12C C13C -11(3)
C2A C3C C12C C13C -164.5(14)
C11C C12C C13C C14C -147.7(13)
C3C C12C C13C C14C 9(2)
C11C C12C C13C C31C -2(2)
C3C C12C C13C C31C 154.1(16)
C31C C13C C14C C15C -147.6(11)
C12C C13C C14C C15C -2.6(18)
C31C C13C C14C C34C -1.3(18)
C12C C13C C14C C34C 143.8(12)
C13C C14C C15C C16C 148.9(11)
C34C C14C C15C C16C -0.7(14)
C13C C14C C15C C4C 0.1(18)
C34C C14C C15C C4C -149.6(11)
C5C C4C C15C C14C 145.5(12)
C3C C4C C15C C14C -2.1(19)
C5C C4C C15C C16C 2(2)
C3C C4C C15C C16C -145.8(12)
C14C C15C C16C C17C -143.8(10)
C4C C15C C16C C17C 1.8(19)
C14C C15C C16C C35C -0.1(13)
C4C C15C C16C C35C 145.5(11)
C15C C16C C17C C38C 151.1(10)
C35C C16C C17C C38C 12.9(17)
C15C C16C C17C C18C -3.2(17)
C35C C16C C17C C18C -141.4(11)
C38C C17C C18C C19C -4.8(17)
C16C C17C C18C C19C 148.5(11)
C38C C17C C18C C5C -152.3(12)
C16C C17C C18C C5C 1.0(19)
C4C C5C C18C C19C -146.5(13)
C6C C5C C18C C19C 6.9(16)
C4C C5C C18C C17C 3(2)
C6C C5C C18C C17C 156.3(11)
C17C C18C C19C C20C -150.2(12)
C5C C18C C19C C20C -0.9(17)
C17C C18C C19C C40C -1.8(19)
C5C C18C C19C C40C 147.6(12)
C18C C19C C20C C21C 142.6(13)
C40C C19C C20C C21C -7(2)
C18C C19C C20C C6C -5.8(17)
C40C C19C C20C C6C -155.6(13)
C1A C6C C20C C19C 164.2(12)
C5C C6C C20C C19C 11(2)
C1A C6C C20C C21C 18(3)
C5C C6C C20C C21C -135.6(14)
C19C C20C C21C C42C 9(2)
C6C C20C C21C C42C 151.6(14)
C19C C20C C21C C22C -137.7(13)
C6C C20C C21C C22C 5(2)
C42C C21C C22C C7C -158.0(11)
C20C C21C C22C C7C -10.0(18)
C42C C21C C22C C23C -2.5(17)
C20C C21C C22C C23C 145.4(12)
C8C C7C C22C C21C 146.8(11)
C1A C7C C22C C21C -4.9(16)
C8C C7C C22C C23C -10.8(13)
C1A C7C C22C C23C -162.5(9)
C21C C22C C23C C44C 1.0(19)
C7C C22C C23C C44C 159.2(11)
C21C C22C C23C C24C -149.9(11)
C7C C22C C23C C24C 8.3(14)
C44C C23C C24C C25C 2.4(19)
C22C C23C C24C C25C 153.2(10)
C44C C23C C24C C8C -153.0(11)
C22C C23C C24C C8C -2.2(14)
C9C C8C C24C C25C 5.6(19)
C7C C8C C24C C25C -156.2(11)
C9C C8C C24C C23C 157.5(10)
C7C C8C C24C C23C -4.3(14)
C23C C24C C25C C26C -153.3(12)
C8C C24C C25C C26C -3.7(19)
C23C C24C C25C C46C -3.6(17)
C8C C24C C25C C46C 146.0(12)
C24C C25C C26C C27C 5.7(19)
C46C C25C C26C C27C -144.4(12)
C24C C25C C26C C49C 151.8(11)
C46C C25C C26C C49C 1.7(19)
C10C C9C C27C C26C 147.2(12)
C8C C9C C27C C26C 11.8(18)
C10C C9C C27C C28C -2.8(18)
C8C C9C C27C C28C -138.2(11)
C25C C26C C27C C9C -10(2)
C49C C26C C27C C9C -159.0(11)
C25C C26C C27C C28C 144.7(13)
C49C C26C C27C C28C -4.0(15)
C9C C27C C28C C29C 8.2(18)
C26C C27C C28C C29C -144.9(11)
C9C C27C C28C C50C 154.9(11)
C26C C27C C28C C50C 1.9(14)
C50C C28C C29C C30C 3.8(17)
C27C C28C C29C C30C 144.8(10)
C50C C28C C29C C11C -144.7(11)
C27C C28C C29C C11C -3.7(16)
C12C C11C C29C C30C -5.8(19)
C10C C11C C29C C30C -153.9(12)
C12C C11C C29C C28C 142.7(13)
C10C C11C C29C C28C -5.3(18)
C28C C29C C30C C31C -146.7(11)
C11C C29C C30C C31C 2.5(18)
C28C C29C C30C C52C -2.7(18)
C11C C29C C30C C52C 146.5(11)
C14C C13C C31C C30C 141.1(11)
C12C C13C C31C C30C -0.6(18)
C14C C13C C31C C32C 1.2(17)
C12C C13C C31C C32C -140.5(12)
C29C C30C C31C C13C 0.6(19)
C52C C30C C31C C13C -148.7(10)
C29C C30C C31C C32C 143.5(10)
C52C C30C C31C C32C -5.8(14)
C13C C31C C32C C53C 150.2(11)
C30C C31C C32C C53C 6.9(14)
C13C C31C C32C C33C 4.1(17)
C30C C31C C32C C33C -139.2(11)
C53C C32C C33C C34C -150.1(12)
C31C C32C C33C C34C -8.9(17)
C53C C32C C33C C56C 4.8(17)
C31C C32C C33C C56C 146.0(11)
C32C C33C C34C C35C 152.2(11)
C56C C33C C34C C35C -1(2)
C32C C33C C34C C14C 8.8(19)
C56C C33C C34C C14C -144.6(12)
C13C C14C C34C C33C -4(2)
C15C C14C C34C C33C 148.6(11)
C13C C14C C34C C35C -151.3(10)
C15C C14C C34C C35C 1.3(14)
C33C C34C C35C C36C -2(2)
C14C C34C C35C C36C 145.7(11)
C33C C34C C35C C16C -149.2(12)
C14C C34C C35C C16C -1.4(14)
C17C C16C C35C C36C -3.7(18)
C15C C16C C35C C36C -146.4(10)
C17C C16C C35C C34C 143.6(11)
C15C C16C C35C C34C 0.9(13)
C34C C35C C36C C37C -151.4(12)
C16C C35C C36C C37C -8.4(17)
C34C C35C C36C C57C 3.3(18)
C16C C35C C36C C57C 146.3(10)
C35C C36C C37C C60C 152.8(11)
C57C C36C C37C C60C -1.3(18)
C35C C36C C37C C38C 10.6(17)
C57C C36C C37C C38C -143.5(11)
C16C C17C C38C C39C -149.3(11)
C18C C17C C38C C39C 5.2(17)
C16C C17C C38C C37C -10.6(18)
C18C C17C C38C C37C 143.9(12)
C60C C37C C38C C17C -145.2(11)
C36C C37C C38C C17C -1.1(19)
C60C C37C C38C C39C -1.8(15)
C36C C37C C38C C39C 142.3(10)
C17C C38C C39C C61C 146.4(10)
C37C C38C C39C C61C 0.1(13)
C17C C38C C39C C40C 0.7(18)
C37C C38C C39C C40C -145.7(11)
C20C C19C C40C C41C -1.7(19)
C18C C19C C40C C41C -146.0(12)
C20C C19C C40C C39C 151.1(13)
C18C C19C C40C C39C 6.7(17)
C61C C39C C40C C41C -0.5(17)
C38C C39C C40C C41C 144.0(12)
C61C C39C C40C C19C -150.9(10)
C38C C39C C40C C19C -6.4(17)
C19C C40C C41C C42C 8.5(17)
C39C C40C C41C C42C -139.9(11)
C19C C40C C41C C63C 144.5(11)
C39C C40C C41C C63C -3.9(18)
C22C C21C C42C C43C 0.4(18)
C20C C21C C42C C43C -146.0(13)
C22C C21C C42C C41C 143.9(11)
C20C C21C C42C C41C -2.5(19)
C40C C41C C42C C21C -6.5(18)
C63C C41C C42C C21C -148.8(11)
C40C C41C C42C C43C 141.0(10)
C63C C41C C42C C43C -1.3(14)
C21C C42C C43C C64C 150.2(11)
C41C C42C C43C C64C 3.4(14)
C21C C42C C43C C44C 3.2(19)
C41C C42C C43C C44C -143.6(10)
C22C C23C C44C C43C 2.5(18)
C24C C23C C44C C43C 148.7(11)
C22C C23C C44C C45C -141.8(12)
C24C C23C C44C C45C 4.5(19)
C64C C43C C44C C23C -147.0(11)
C42C C43C C44C C23C -4.6(17)
C64C C43C C44C C45C 1.1(16)
C42C C43C C44C C45C 143.5(12)
C23C C44C C45C C66C 147.8(12)
C43C C44C C45C C66C 2.1(17)
C23C C44C C45C C46C -9.2(17)
C43C C44C C45C C46C -154.9(10)
C24C C25C C46C C47C -150.8(11)
C26C C25C C46C C47C -3.9(18)
C24C C25C C46C C45C -1.4(17)
C26C C25C C46C C45C 145.5(11)
C44C C45C C46C C47C 157.3(11)
C66C C45C C46C C47C -1.2(17)
C44C C45C C46C C25C 7.6(17)
C66C C45C C46C C25C -150.8(10)
C25C C46C C47C C48C 6.2(18)
C45C C46C C47C C48C -144.0(11)
C25C C46C C47C C68C 146.0(12)
C45C C46C C47C C68C -4.1(19)
C46C C47C C48C C49C -7(2)
C68C C47C C48C C49C -152.6(11)
C46C C47C C48C C70C 141.0(11)
C68C C47C C48C C70C -5.0(14)
C47C C48C C49C C50C 144.2(11)
C70C C48C C49C C50C -0.3(18)
C47C C48C C49C C26C 4(2)
C70C C48C C49C C26C -140.2(12)
C25C C26C C49C C48C -2(2)
C27C C26C C49C C48C 149.5(11)
C25C C26C C49C C50C -146.7(11)
C27C C26C C49C C50C 4.6(15)
C29C C28C C50C C51C -0.9(17)
C27C C28C C50C C51C -145.0(10)
C29C C28C C50C C49C 145.1(10)
C27C C28C C50C C49C 1.0(13)
C48C C49C C50C C28C -148.4(11)
C26C C49C C50C C28C -3.4(14)
C48C C49C C50C C51C -5.3(18)
C26C C49C C50C C51C 139.6(11)
C28C C50C C51C C52C -3.2(16)
C49C C50C C51C C52C -143.5(11)
C28C C50C C51C C71C 146.7(10)
C49C C50C C51C C71C 6.5(16)
C50C C51C C52C C30C 4.1(17)
C71C C51C C52C C30C -143.8(10)
C50C C51C C52C C53C 143.9(11)
C71C C51C C52C C53C -4.0(18)
C29C C30C C52C C51C -1.1(18)
C31C C30C C52C C51C 147.9(10)
C29C C30C C52C C53C -146.6(11)
C31C C30C C52C C53C 2.4(14)
C33C C32C C53C C54C -5.5(19)
C31C C32C C53C C54C -152.2(11)
C33C C32C C53C C52C 141.5(11)
C31C C32C C53C C52C -5.2(14)
C51C C52C C53C C54C 5(2)
C30C C52C C53C C54C 147.5(11)
C51C C52C C53C C32C -140.9(11)
C30C C52C C53C C32C 1.8(14)
C32C C53C C54C C55C 3.5(19)
C52C C53C C54C C55C -138.8(13)
C32C C53C C54C C72C 143.0(11)
C52C C53C C54C C72C 0.7(17)
C53C C54C C55C C56C -1.0(18)
C72C C54C C55C C56C -141.5(10)
C53C C54C C55C C74C 147.7(11)
C72C C54C C55C C74C 7.2(13)
C54C C55C C56C C57C 148.5(10)
C74C C55C C56C C57C 3.8(17)
C54C C55C C56C C33C 0.3(17)
C74C C55C C56C C33C -144.3(11)
C34C C33C C56C C57C 3.0(17)
C32C C33C C56C C57C -150.5(10)
C34C C33C C56C C55C 151.3(12)
C32C C33C C56C C55C -2.3(16)
C55C C56C C57C C58C 4.0(17)
C33C C56C C57C C58C 153.6(10)
C55C C56C C57C C36C -151.5(10)
C33C C56C C57C C36C -1.8(17)
C35C C36C C57C C56C -1.2(17)
C37C C36C C57C C56C 152.7(11)
C35C C36C C57C C58C -157.4(10)
C37C C36C C57C C58C -3.5(16)
C56C C57C C58C C75C -10.0(19)
C36C C57C C58C C75C 146.9(11)
C56C C57C C58C C59C -149.6(11)
C36C C57C C58C C59C 7.4(17)
C75C C58C C59C C60C -151.4(10)
C57C C58C C59C C60C -6.4(18)
C75C C58C C59C C77C -7.3(13)
C57C C58C C59C C77C 137.7(11)
C58C C59C C60C C37C 1.0(19)
C77C C59C C60C C37C -137.0(12)
C58C C59C C60C C61C 139.3(11)
C77C C59C C60C C61C 1.3(18)
C38C C37C C60C C59C 146.5(11)
C36C C37C C60C C59C 2.8(19)
C38C C37C C60C C61C 2.6(14)
C36C C37C C60C C61C -141.1(11)
C38C C39C C61C C60C 1.5(13)
C40C C39C C61C C60C 151.8(9)
C38C C39C C61C C62C -145.5(10)
C40C C39C C61C C62C 4.8(16)
C59C C60C C61C C39C -148.4(10)
C37C C60C C61C C39C -2.4(13)
C59C C60C C61C C62C -0.2(16)
C37C C60C C61C C62C 145.7(10)
C39C C61C C62C C63C -5.1(16)
C60C C61C C62C C63C -148.6(10)
C39C C61C C62C C78C 141.1(11)
C60C C61C C62C C78C -2.5(16)
C78C C62C C63C C64C -2.3(18)
C61C C62C C63C C64C 143.5(10)
C78C C62C C63C C41C -145.2(11)
C61C C62C C63C C41C 0.7(17)
C40C C41C C63C C62C 3.5(18)
C42C C41C C63C C62C 145.2(11)
C40C C41C C63C C64C -142.9(11)
C42C C41C C63C C64C -1.2(14)
C44C C43C C64C C65C -1.9(17)
C42C C43C C64C C65C -148.6(11)
C44C C43C C64C C63C 142.6(11)
C42C C43C C64C C63C -4.1(13)
C62C C63C C64C C65C 0.9(18)
C41C C63C C64C C65C 147.4(10)
C62C C63C C64C C43C -143.2(10)
C41C C63C C64C C43C 3.3(14)
C43C C64C C65C C66C -0.9(18)
C63C C64C C65C C66C -140.8(12)
C43C C64C C65C C79C 141.3(11)
C63C C64C C65C C79C 1.4(18)
C64C C65C C66C C67C 153.1(10)
C79C C65C C66C C67C 6.4(14)
C64C C65C C66C C45C 4.1(19)
C79C C65C C66C C45C -142.6(11)
C44C C45C C66C C65C -4.9(19)
C46C C45C C66C C65C 151.7(11)
C44C C45C C66C C67C -151.8(11)
C46C C45C C66C C67C 4.8(17)
C65C C66C C67C C68C -152.2(10)
C45C C66C C67C C68C -3.4(18)
C65C C66C C67C C80C -6.7(14)
C45C C66C C67C C80C 142.1(10)
C80C C67C C68C C69C 1.9(17)
C66C C67C C68C C69C 139.9(11)
C80C C67C C68C C47C -139.8(11)
C66C C67C C68C C47C -1.9(18)
C46C C47C C68C C67C 6(2)
C48C C47C C68C C67C 150.8(10)
C46C C47C C68C C69C -138.5(13)
C48C C47C C68C C69C 6.3(14)
C67C C68C C69C C82C -5.2(18)
C47C C68C C69C C82C 140.2(11)
C67C C68C C69C C70C -150.5(10)
C47C C68C C69C C70C -5.2(14)
C82C C69C C70C C71C -1.8(19)
C68C C69C C70C C71C 146.0(11)
C82C C69C C70C C48C -145.9(10)
C68C C69C C70C C48C 1.9(13)
C49C C48C C70C C71C 3.7(17)
C47C C48C C70C C71C -144.7(11)
C49C C48C C70C C69C 150.4(11)
C47C C48C C70C C69C 2.0(13)
C69C C70C C71C C72C 7.8(18)
C48C C70C C71C C72C 147.9(11)
C69C C70C C71C C51C -142.2(11)
C48C C70C C71C C51C -2.1(18)
C50C C51C C71C C70C -2.8(16)
C52C C51C C71C C70C 148.1(11)
C50C C51C C71C C72C -153.1(10)
C52C C51C C71C C72C -2.2(16)
C70C C71C C72C C73C -7.1(18)
C51C C71C C72C C73C 145.9(11)
C70C C71C C72C C54C -144.6(11)
C51C C71C C72C C54C 8.4(18)
C55C C54C C72C C71C 138.4(12)
C53C C54C C72C C71C -7.8(18)
C55C C54C C72C C73C -5.8(12)
C53C C54C C72C C73C -152.0(9)
C71C C72C C73C C74C -144.4(11)
C54C C72C C73C C74C 2.5(14)
C71C C72C C73C C82C 0.8(19)
C54C C72C C73C C82C 147.7(9)
C72C C73C C74C C75C 143.6(12)
C82C C73C C74C C75C -2.8(18)
C72C C73C C74C C55C 1.3(14)
C82C C73C C74C C55C -145.1(10)
C54C C55C C74C C75C -152.2(10)
C56C C55C C74C C75C -5.9(18)
C54C C55C C74C C73C -5.4(13)
C56C C55C C74C C73C 140.9(11)
C73C C74C C75C C58C -137.9(12)
C55C C74C C75C C58C -0.2(18)
C73C C74C C75C C76C 7.0(18)
C55C C74C C75C C76C 144.7(10)
C59C C58C C75C C74C 153.3(10)
C57C C58C C75C C74C 8.2(19)
C59C C58C C75C C76C 7.1(13)
C57C C58C C75C C76C -138.0(11)
C74C C75C C76C C77C -152.0(10)
C58C C75C C76C C77C -3.9(14)
C74C C75C C76C C81C -7.0(17)
C58C C75C C76C C81C 141.1(12)
C81C C76C C77C C59C -146.2(11)
C75C C76C C77C C59C -1.0(14)
C81C C76C C77C C78C 3(2)
C75C C76C C77C C78C 148.0(10)
C60C C59C C77C C76C 147.5(11)
C58C C59C C77C C76C 5.2(15)
C60C C59C C77C C78C 0(2)
C58C C59C C77C C78C -142.2(11)
C63C C62C C78C C79C 1.5(18)
C61C C62C C78C C79C -143.5(11)
C63C C62C C78C C77C 148.6(11)
C61C C62C C78C C77C 3.6(16)
C76C C77C C78C C79C 3.1(18)
C59C C77C C78C C79C 147.8(12)
C76C C77C C78C C62C -147.4(12)
C59C C77C C78C C62C -2.7(18)
C62C C78C C79C C80C 143.4(13)
C77C C78C C79C C80C -5(2)
C62C C78C C79C C65C 0.7(18)
C77C C78C C79C C65C -147.4(10)
C66C C65C C79C C80C -3.7(14)
C64C C65C C79C C80C -151.6(11)
C66C C65C C79C C78C 145.7(12)
C64C C65C C79C C78C -2.2(18)
C78C C79C C80C C67C -145.8(12)
C65C C79C C80C C67C -0.5(14)
C78C C79C C80C C81C 0(2)
C65C C79C C80C C81C 145.5(11)
C68C C67C C80C C79C 148.2(11)
C66C C67C C80C C79C 3.9(13)
C68C C67C C80C C81C 0.3(17)
C66C C67C C80C C81C -144.0(10)
C77C C76C C81C C80C -7(2)
C75C C76C C81C C80C -146.4(11)
C77C C76C C81C C82C 142.4(12)
C75C C76C C81C C82C 3.2(18)
C79C C80C C81C C76C 6.0(19)
C67C C80C C81C C76C 149.4(11)
C79C C80C C81C C82C -143.1(13)
C67C C80C C81C C82C 0.3(17)
C68C C69C C82C C73C -147.1(11)
C70C C69C C82C C73C -5.1(17)
C68C C69C C82C C81C 5.6(18)
C70C C69C C82C C81C 147.6(11)
C74C C73C C82C C69C 150.2(11)
C72C C73C C82C C69C 5.6(17)
C74C C73C C82C C81C -1.5(16)
C72C C73C C82C C81C -146.1(11)
C76C C81C C82C C69C -151.7(11)
C80C C81C C82C C69C -3.0(17)
C76C C81C C82C C73C 1.1(17)
C80C C81C C82C C73C 149.8(10)
C1D C11 C12 C16 -76(3)
C2D C11 C12 C16 -179(3)
C13 C11 C12 C16 54(3)
C1D C11 C12 C17 168.6(18)
C2D C11 C12 C17 66(3)
C13 C11 C12 C17 -61(2)
C12 C11 C13 C14 -58(2)
C1D C11 C13 C14 77(3)
C2D C11 C13 C14 177.0(18)
C12 C11 C13 C15 61(2)
C1D C11 C13 C15 -164(2)
C2D C11 C13 C15 -64(3)
C15 C13 C14 C18 -65(2)
C11 C13 C14 C18 55(3)
C14 C13 C15 C19 61(2)
C11 C13 C15 C19 -61(3)
C11 C12 C16 C18 -64(4)
C17 C12 C16 C18 54(4)
C16 C12 C17 C19 -53(3)
C11 C12 C17 C19 60(2)
C12 C16 C18 C20 -53(4)
C12 C16 C18 C14 62(4)
C13 C14 C18 C16 -50(3)
C13 C14 C18 C20 62(3)
C13 C15 C19 C20 -57(3)
C13 C15 C19 C17 62(2)
C12 C17 C19 C20 62(2)
C12 C17 C19 C15 -61(2)
C15 C19 C20 C18 56(3)
C17 C19 C20 C18 -65(3)
C16 C18 C20 C19 55(3)
C14 C18 C20 C19 -58(3)
C12 C11 C1D C10D 155(2)
C2D C11 C1D C10D -91(3)
C13 C11 C1D C10D 25(3)
C12 C11 C1D C3D -27(2)
C2D C11 C1D C3D 87(3)
C13 C11 C1D C3D -156(2)
C12 C11 C2D C6D 40(3)
C1D C11 C2D C6D -82(3)
C13 C11 C2D C6D 164.5(19)
C12 C11 C2D C7D -163(2)
C1D C11 C2D C7D 75(3)
C13 C11 C2D C7D -39.3(18)
C10D C1D C3D C12D -9.1(16)
C11 C1D C3D C12D 172.3(12)
C10D C1D C3D C4D 127.5(15)
C11 C1D C3D C4D -51(2)
C12D C3D C4D C5D 130.5(16)
C1D C3D C4D C5D 1(3)
C12D C3D C4D C15D -22(2)
C1D C3D C4D C15D -151.4(15)
C15D C4D C5D C18D 1(3)
C3D C4D C5D C18D -149.9(16)
C15D C4D C5D C6D 148.4(18)
C3D C4D C5D C6D -2(3)
C11 C2D C6D C20D -177.3(15)
C7D C2D C6D C20D 25(2)
C11 C2D C6D C5D 39(3)
C7D C2D C6D C5D -118(2)
C4D C5D C6D C2D 7(3)
C18D C5D C6D C2D 156.3(18)
C4D C5D C6D C20D -141.6(17)
C18D C5D C6D C20D 8(2)
C6D C2D C7D C22D -30.1(18)
C11 C2D C7D C22D 171.5(16)
C6D C2D C7D C8D 125.5(18)
C11 C2D C7D C8D -33(2)
C22D C7D C8D C24D -1.2(19)
C2D C7D C8D C24D -158.2(15)
C22D C7D C8D C9D 141.6(16)
C2D C7D C8D C9D -15(3)
C24D C8D C9D C27D -7(2)
C7D C8D C9D C27D -144.9(16)
C24D C8D C9D C10D 145.7(16)
C7D C8D C9D C10D 8(3)
C11 C1D C10D C11D -169.6(12)
C3D C1D C10D C11D 11.9(18)
C11 C1D C10D C9D 50(3)
C3D C1D C10D C9D -128.5(18)
C27D C9D C10D C1D 151.9(19)
C8D C9D C10D C1D 0(3)
C27D C9D C10D C11D 14(2)
C8D C9D C10D C11D -137.3(17)
C1D C10D C11D C29D -163.5(15)
C9D C10D C11D C29D -17(3)
C1D C10D C11D C12D -10(2)
C9D C10D C11D C12D 136.4(15)
C29D C11D C12D C3D 159.6(15)
C10D C11D C12D C3D 4(2)
C29D C11D C12D C13D 0(3)
C10D C11D C12D C13D -155.0(17)
C4D C3D C12D C11D -137.6(15)
C1D C3D C12D C11D 2.8(19)
C4D C3D C12D C13D 21(2)
C1D C3D C12D C13D 161.6(16)
C11D C12D C13D C14D 149.9(17)
C3D C12D C13D C14D -8(3)
C11D C12D C13D C31D -2(3)
C3D C12D C13D C31D -159.0(17)
C31D C13D C14D C15D 148.0(17)
C12D C13D C14D C15D -4(3)
C31D C13D C14D C34D 10(3)
C12D C13D C14D C34D -141.3(17)
C13D C14D C15D C16D -146.0(16)
C34D C14D C15D C16D -3(2)
C13D C14D C15D C4D 1(3)
C34D C14D C15D C4D 143.7(18)
C5D C4D C15D C14D -141.6(19)
C3D C4D C15D C14D 12(3)
C5D C4D C15D C16D 2(3)
C3D C4D C15D C16D 155.0(17)
C14D C15D C16D C17D 146.8(17)
C4D C15D C16D C17D -3(3)
C14D C15D C16D C35D 2(2)
C4D C15D C16D C35D -147.9(17)
C15D C16D C17D C38D -149.4(18)
C35D C16D C17D C38D -6(3)
C15D C16D C17D C18D 2(3)
C35D C16D C17D C18D 144.8(16)
C38D C17D C18D C19D 6(3)
C16D C17D C18D C19D -147.1(17)
C38D C17D C18D C5D 153.9(18)
C16D C17D C18D C5D 1(3)
C4D C5D C18D C19D 149.8(15)
C6D C5D C18D C19D -2(2)
C4D C5D C18D C17D -2(3)
C6D C5D C18D C17D -153.8(18)
C17D C18D C19D C20D 148.0(16)
C5D C18D C19D C20D -5(2)
C17D C18D C19D C40D 3(3)
C5D C18D C19D C40D -149.9(16)
C18D C19D C20D C21D -147.1(17)
C40D C19D C20D C21D -2(3)
C18D C19D C20D C6D 11(2)
C40D C19D C20D C6D 155.7(18)
C2D C6D C20D C19D -164.2(16)
C5D C6D C20D C19D -11(2)
C2D C6D C20D C21D -7(3)
C5D C6D C20D C21D 146.1(17)
C19D C20D C21D C22D 147.1(18)
C6D C20D C21D C22D -9(3)
C19D C20D C21D C42D -5(3)
C6D C20D C21D C42D -161.0(19)
C42D C21D C22D C23D 12(3)
C20D C21D C22D C23D -140.7(18)
C42D C21D C22D C7D 156.0(17)
C20D C21D C22D C7D 3(3)
C8D C7D C22D C21D -143.8(16)
C2D C7D C22D C21D 16(3)
C8D C7D C22D C23D 4(2)
C2D C7D C22D C23D 164.0(14)
C21D C22D C23D C44D -5(3)
C7D C22D C23D C44D -153.1(17)
C21D C22D C23D C24D 143.3(17)
C7D C22D C23D C24D -5(2)
C44D C23D C24D C25D -1(3)
C22D C23D C24D C25D -150.2(16)
C44D C23D C24D C8D 153.3(17)
C22D C23D C24D C8D 4(2)
C9D C8D C24D C25D 6(3)
C7D C8D C24D C25D 151.4(17)
C9D C8D C24D C23D -147.7(16)
C7D C8D C24D C23D -2(2)
C23D C24D C25D C26D 157.2(17)
C8D C24D C25D C26D 6(3)
C23D C24D C25D C46D -3(3)
C8D C24D C25D C46D -153.7(16)
C24D C25D C26D C27D -16(3)
C46D C25D C26D C27D 143.0(17)
C24D C25D C26D C49D -149.4(17)
C46D C25D C26D C49D 10(3)
C10D C9D C27D C26D -155.8(17)
C8D C9D C27D C26D -3(3)
C10D C9D C27D C28D -6(3)
C8D C9D C27D C28D 147.3(17)
C25D C26D C27D C9D 15(3)
C49D C26D C27D C9D 151.4(16)
C25D C26D C27D C28D -137.8(17)
C49D C26D C27D C28D -2(2)
C9D C27D C28D C29D -2(3)
C26D C27D C28D C29D 152.5(17)
C9D C27D C28D C50D -156.0(15)
C26D C27D C28D C50D -1(2)
C50D C28D C29D C30D 6(3)
C27D C28D C29D C30D -142.2(17)
C50D C28D C29D C11D 148.7(18)
C27D C28D C29D C11D 0(3)
C12D C11D C29D C30D 1(3)
C10D C11D C29D C30D 151.0(17)
C12D C11D C29D C28D -140.1(17)
C10D C11D C29D C28D 10(3)
C28D C29D C30D C31D 139.5(18)
C11D C29D C30D C31D -1(3)
C28D C29D C30D C52D -4(3)
C11D C29D C30D C52D -144.2(16)
C14D C13D C31D C30D -150.8(17)
C12D C13D C31D C30D 1(3)
C14D C13D C31D C32D 0(3)
C12D C13D C31D C32D 152.5(17)
C29D C30D C31D C13D 0(3)
C52D C30D C31D C13D 149.3(17)
C29D C30D C31D C32D -154.1(15)
C52D C30D C31D C32D -4(2)
C13D C31D C32D C53D -148.8(17)
C30D C31D C32D C53D 5(2)
C13D C31D C32D C33D -13(3)
C30D C31D C32D C33D 141.0(15)
C53D C32D C33D C34D 145.0(18)
C31D C32D C33D C34D 15(3)
C53D C32D C33D C56D -9(3)
C31D C32D C33D C56D -139.3(16)
C32D C33D C34D C35D -151.2(17)
C56D C33D C34D C35D 3(3)
C32D C33D C34D C14D -5(3)
C56D C33D C34D C14D 149.8(17)
C13D C14D C34D C33D -8(3)
C15D C14D C34D C33D -148.7(18)
C13D C14D C34D C35D 143.6(16)
C15D C14D C34D C35D 3(2)
C33D C34D C35D C36D -3(3)
C14D C34D C35D C36D -152.4(15)
C33D C34D C35D C16D 147.9(19)
C14D C34D C35D C16D -2(2)
C17D C16D C35D C36D -2(3)
C15D C16D C35D C36D 146.1(18)
C17D C16D C35D C34D -148.8(17)
C15D C16D C35D C34D 0(2)
C34D C35D C36D C37D 151.9(18)
C16D C35D C36D C37D 8(3)
C34D C35D C36D C57D 2(3)
C16D C35D C36D C57D -141.3(18)
C35D C36D C37D C60D -150.8(18)
C57D C36D C37D C60D 0(3)
C35D C36D C37D C38D -7(3)
C57D C36D C37D C38D 144.3(18)
C16D C17D C38D C39D 144.9(17)
C18D C17D C38D C39D -6(3)
C16D C17D C38D C37D 8(3)
C18D C17D C38D C37D -142.6(17)
C60D C37D C38D C17D 146.7(15)
C36D C37D C38D C17D -1(3)
C60D C37D C38D C39D 4(2)
C36D C37D C38D C39D -143.3(18)
C17D C38D C39D C61D -143.3(16)
C37D C38D C39D C61D -2(2)
C17D C38D C39D C40D -4(3)
C37D C38D C39D C40D 137.4(17)
C20D C19D C40D C41D 10(3)
C18D C19D C40D C41D 149.2(17)
C20D C19D C40D C39D -151.1(17)
C18D C19D C40D C39D -12(3)
C61D C39D C40D C41D -7(3)
C38D C39D C40D C41D -146.2(19)
C61D C39D C40D C19D 151.3(16)
C38D C39D C40D C19D 12(3)
C19D C40D C41D C42D -11(3)
C39D C40D C41D C42D 147.0(19)
C19D C40D C41D C63D -149.3(16)
C39D C40D C41D C63D 8(3)
C22D C21D C42D C43D -10(3)
C20D C21D C42D C43D 142.1(19)
C22D C21D C42D C41D -147.9(18)
C20D C21D C42D C41D 4(3)
C40D C41D C42D C21D 4(3)
C63D C41D C42D C21D 146.8(17)
C40D C41D C42D C43D -139.3(16)
C63D C41D C42D C43D 4(2)
C21D C42D C43D C64D -145.0(18)
C41D C42D C43D C64D -2(2)
C21D C42D C43D C44D 0(3)
C41D C42D C43D C44D 142.7(16)
C22D C23D C44D C43D -5(3)
C24D C23D C44D C43D -148.7(17)
C22D C23D C44D C45D 144.6(18)
C24D C23D C44D C45D 1(3)
C64D C43D C44D C23D 147.9(18)
C42D C43D C44D C23D 7(3)
C64D C43D C44D C45D -5(3)
C42D C43D C44D C45D -146.2(18)
C23D C44D C45D C66D -149.4(17)
C43D C44D C45D C66D 1(3)
C23D C44D C45D C46D 3(3)
C43D C44D C45D C46D 153.7(15)
C24D C25D C46D C47D 152.8(16)
C26D C25D C46D C47D -5(3)
C24D C25D C46D C45D 7(3)
C26D C25D C46D C45D -151.1(16)
C44D C45D C46D C47D -152.7(16)
C66D C45D C46D C47D 1(3)
C44D C45D C46D C25D -7(2)
C66D C45D C46D C25D 146.8(16)
C25D C46D C47D C48D 2(3)
C45D C46D C47D C48D 149.7(17)
C25D C46D C47D C68D -145.1(17)
C45D C46D C47D C68D 2(3)
C46D C47D C48D C49D -4(3)
C68D C47D C48D C49D 148.6(15)
C46D C47D C48D C70D -139.7(18)
C68D C47D C48D C70D 13(2)
C47D C48D C49D C50D -140.6(17)
C70D C48D C49D C50D -8(3)
C47D C48D C49D C26D 9(3)
C70D C48D C49D C26D 141.2(18)
C25D C26D C49D C48D -11(3)
C27D C26D C49D C48D -149.8(16)
C25D C26D C49D C50D 142.7(15)
C27D C26D C49D C50D 4(2)
C29D C28D C50D C49D -148.7(18)
C27D C28D C50D C49D 4(2)
C29D C28D C50D C51D -9(3)
C27D C28D C50D C51D 144.3(15)
C48D C49D C50D C28D 148.6(17)
C26D C49D C50D C28D -5(2)
C48D C49D C50D C51D 11(3)
C26D C49D C50D C51D -143.0(16)
C28D C50D C51D C52D 9(3)
C49D C50D C51D C52D 144.6(17)
C28D C50D C51D C71D -146.4(17)
C49D C50D C51D C71D -10(2)
C29D C30D C52D C51D 4(3)
C31D C30D C52D C51D -143.6(16)
C29D C30D C52D C53D 149.7(16)
C31D C30D C52D C53D 2(2)
C50D C51D C52D C30D -7(3)
C71D C51D C52D C30D 148.2(16)
C50D C51D C52D C53D -145.0(18)
C71D C51D C52D C53D 10(3)
C33D C32D C53D C54D 9(3)
C31D C32D C53D C54D 145.2(17)
C33D C32D C53D C52D -140.0(15)
C31D C32D C53D C52D -4(2)
C30D C52D C53D C54D -148.3(15)
C51D C52D C53D C54D -7(3)
C30D C52D C53D C32D 1(2)
C51D C52D C53D C32D 142.1(16)
C32D C53D C54D C55D -4(3)
C52D C53D C54D C55D 141.7(19)
C32D C53D C54D C72D -148.0(17)
C52D C53D C54D C72D -2(2)
C53D C54D C55D C56D 0(3)
C72D C54D C55D C56D 144.4(15)
C53D C54D C55D C74D -151.4(16)
C72D C54D C55D C74D -7(2)
C54D C55D C56D C57D -148.6(16)
C74D C55D C56D C57D -3(3)
C54D C55D C56D C33D 0(3)
C74D C55D C56D C33D 145.6(17)
C34D C33D C56D C57D -4(3)
C32D C33D C56D C57D 151.1(14)
C34D C33D C56D C55D -149.7(17)
C32D C33D C56D C55D 5(3)
C55D C56D C57D C58D -2(3)
C33D C56D C57D C58D -149.3(15)
C55D C56D C57D C36D 150.8(14)
C33D C56D C57D C36D 3(3)
C35D C36D C57D C56D -3(3)
C37D C36D C57D C56D -149.9(16)
C35D C36D C57D C58D 151.4(15)
C37D C36D C57D C58D 4(2)
C56D C57D C58D C75D 10(3)
C36D C57D C58D C75D -143.2(18)
C56D C57D C58D C59D 146.7(17)
C36D C57D C58D C59D -6(2)
C75D C58D C59D C60D 145.2(16)
C57D C58D C59D C60D 4(3)
C75D C58D C59D C77D 0(2)
C57D C58D C59D C77D -140.9(16)
C58D C59D C60D C37D 1(3)
C77D C59D C60D C37D 138.3(19)
C58D C59D C60D C61D -143.7(16)
C77D C59D C60D C61D -6(3)
C38D C37D C60D C59D -152.4(16)
C36D C37D C60D C59D -3(3)
C38D C37D C60D C61D -5(2)
C36D C37D C60D C61D 144.6(17)
C38D C39D C61D C60D -1(2)
C40D C39D C61D C60D -145.4(15)
C38D C39D C61D C62D 145.8(16)
C40D C39D C61D C62D 1(3)
C59D C60D C61D C39D 153.0(15)
C37D C60D C61D C39D 4(2)
C59D C60D C61D C62D 5(3)
C37D C60D C61D C62D -144.6(16)
C39D C61D C62D C63D 3(3)
C60D C61D C62D C63D 144.8(16)
C39D C61D C62D C78D -140.6(17)
C60D C61D C62D C78D 1(2)
C78D C62D C63D C64D 1(3)
C61D C62D C63D C64D -141.1(16)
C78D C62D C63D C41D 139.7(16)
C61D C62D C63D C41D -3(2)
C40D C41D C63D C62D -2(3)
C42D C41D C63D C62D -146.0(16)
C40D C41D C63D C64D 140.4(17)
C42D C41D C63D C64D -3(2)
C44D C43D C64D C65D 6(3)
C42D C43D C64D C65D 151.1(17)
C44D C43D C64D C63D -144.9(16)
C42D C43D C64D C63D 0(2)
C62D C63D C64D C65D -4(3)
C41D C63D C64D C65D -148.5(16)
C62D C63D C64D C43D 146.2(15)
C41D C63D C64D C43D 2(2)
C43D C64D C65D C66D -1(3)
C63D C64D C65D C66D 146.2(17)
C43D C64D C65D C79D -143.1(17)
C63D C64D C65D C79D 4(3)
C64D C65D C66D C67D -149.5(15)
C79D C65D C66D C67D -4(2)
C64D C65D C66D C45D -4(3)
C79D C65D C66D C45D 142.1(16)
C44D C45D C66D C65D 4(3)
C46D C45D C66D C65D -147.8(15)
C44D C45D C66D C67D 146.7(17)
C46D C45D C66D C67D -5(3)
C65D C66D C67D C68D 151.1(14)
C45D C66D C67D C68D 5(3)
C65D C66D C67D C80D 5(2)
C45D C66D C67D C80D -141.7(16)
C80D C67D C68D C69D -4(3)
C66D C67D C68D C69D -144.8(17)
C80D C67D C68D C47D 139.3(17)
C66D C67D C68D C47D -1(3)
C46D C47D C68D C67D -3(3)
C48D C47D C68D C67D -154.8(15)
C46D C47D C68D C69D 143.8(17)
C48D C47D C68D C69D -8(2)
C67D C68D C69D C82D 7(3)
C47D C68D C69D C82D -139.2(16)
C67D C68D C69D C70D 147.0(16)
C47D C68D C69D C70D 0(2)
C82D C69D C70D C71D -5(3)
C68D C69D C70D C71D -147.7(18)
C82D C69D C70D C48D 149.7(15)
C68D C69D C70D C48D 7(2)
C49D C48D C70D C71D 6(3)
C47D C48D C70D C71D 143.4(17)
C49D C48D C70D C69D -150.2(15)
C47D C48D C70D C69D -13(2)
C69D C70D C71D C72D -1(3)
C48D C70D C71D C72D -153.3(17)
C69D C70D C71D C51D 145.1(18)
C48D C70D C71D C51D -7(3)
C50D C51D C71D C70D 9(3)
C52D C51D C71D C70D -148.2(16)
C50D C51D C71D C72D 154.5(15)
C52D C51D C71D C72D -2(2)
C70D C71D C72D C73D 7(3)
C51D C71D C72D C73D -140.9(16)
C70D C71D C72D C54D 140.7(16)
C51D C71D C72D C54D -7(2)
C55D C54D C72D C71D -138.3(16)
C53D C54D C72D C71D 10(2)
C55D C54D C72D C73D 3.5(19)
C53D C54D C72D C73D 151.4(14)
C71D C72D C73D C74D 144.5(16)
C54D C72D C73D C74D 1.3(19)
C71D C72D C73D C82D -6(3)
C54D C72D C73D C82D -148.8(15)
C72D C73D C74D C75D -142.7(16)
C82D C73D C74D C75D 7(3)
C72D C73D C74D C55D -5(2)
C82D C73D C74D C55D 144.4(15)
C54D C55D C74D C75D 148.4(16)
C56D C55D C74D C75D -1(3)
C54D C55D C74D C73D 7(2)
C56D C55D C74D C73D -141.7(17)
C73D C74D C75D C58D 143(2)
C55D C74D C75D C58D 9(3)
C73D C74D C75D C76D -15(3)
C55D C74D C75D C76D -148.6(17)
C59D C58D C75D C74D -156.4(18)
C57D C58D C75D C74D -14(3)
C59D C58D C75D C76D 3(2)
C57D C58D C75D C76D 145.3(16)
C74D C75D C76D C77D 155.3(16)
C58D C75D C76D C77D -5(2)
C74D C75D C76D C81D 17(3)
C58D C75D C76D C81D -143.5(17)
C81D C76D C77D C59D 141.4(16)
C75D C76D C77D C59D 5(2)
C81D C76D C77D C78D -8(3)
C75D C76D C77D C78D -144.0(16)
C60D C59D C77D C76D -146.1(16)
C58D C59D C77D C76D -4(2)
C60D C59D C77D C78D 2(3)
C58D C59D C77D C78D 144.3(16)
C63D C62D C78D C79D 2(3)
C61D C62D C78D C79D 143.0(15)
C63D C62D C78D C77D -146.3(15)
C61D C62D C78D C77D -5(2)
C76D C77D C78D C79D 0(3)
C59D C77D C78D C79D -146.3(16)
C76D C77D C78D C62D 150.5(17)
C59D C77D C78D C62D 4(3)
C62D C78D C79D C80D -144.5(18)
C77D C78D C79D C80D 5(3)
C62D C78D C79D C65D -2(3)
C77D C78D C79D C65D 147.3(14)
C66D C65D C79D C80D 1(2)
C64D C65D C79D C80D 148.3(17)
C66D C65D C79D C78D -147.8(16)
C64D C65D C79D C78D -1(2)
C78D C79D C80D C67D 147.3(16)
C65D C79D C80D C67D 2(2)
C78D C79D C80D C81D -2(3)
C65D C79D C80D C81D -147.3(17)
C68D C67D C80D C79D -150.1(16)
C66D C67D C80D C79D -4(2)
C68D C67D C80D C81D 0(3)
C66D C67D C80D C81D 146.9(16)
C77D C76D C81D C80D 11(3)
C75D C76D C81D C80D 141.1(17)
C77D C76D C81D C82D -141.4(17)
C75D C76D C81D C82D -11(3)
C79D C80D C81D C76D -6(3)
C67D C80D C81D C76D -152.5(16)
C79D C80D C81D C82D 146.8(18)
C67D C80D C81D C82D 1(3)
C68D C69D C82D C73D 142.5(16)
C70D C69D C82D C73D 7(3)
C68D C69D C82D C81D -6(3)
C70D C69D C82D C81D -141.6(17)
C74D C73D C82D C69D -150.0(16)
C72D C73D C82D C69D -2(3)
C74D C73D C82D C81D -1(2)
C72D C73D C82D C81D 147.1(15)
C76D C81D C82D C69D 153.6(15)
C80D C81D C82D C69D 2(3)
C76D C81D C82D C73D 4(3)
C80D C81D C82D C73D -148.0(16)
loop_
_cod_changelog_entry_id
_cod_changelog_entry_author
_cod_changelog_entry_date
_cod_changelog_entry_text
1 'Vaitkus, Antanas' 2024-11-16T00:18:53+02:00
;
 Replaced the '\/Y' character sequence with the backslash character ('\')
 in the '_diffrn_measurement_method' data value.
;
